CMPD_CHEMBLID	CANONICAL_SMILES	STANDARD_VALUE	STANDARD_UNITS	PUBMED_ID
CHEMBL338099	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4ccnc4	0.6	nM	7504733
CHEMBL223228	FC(F)(F)[C@]1(OC(=O)Nc2ccc(Cl)cc12)C#CC3CC3	0.75	nM	14971897
CHEMBL135380	Clc1ccc(NC(=S)NCCN2C(=O)c3ccccc3C2=O)nc1	1	nM	8863804
CHEMBL253186	COc1ccc(OC)c(CCNC(=S)Nc2ccc(Cl)cn2)c1F	1	nM	8863804
CHEMBL88677	Fc1cccc(F)c1CC\N=C(/S)\Nc2ccc(Br)cn2	1	nM	8863804
CHEMBL37024	CCOc1ccc(F)c([C@H]2C[C@H]2NC(=O)Nc3ccc(Cl)cn3)c1F	1.5	nM	9873380
CHEMBL541204	CCOc1ccc(F)c(C2CC2NC(=O)Nc3ccc(Cl)cn3)c1F	1.6	nM	10514285
CHEMBL436376	CCOc1ccc(F)c(CC\N=C(/S)\Nc2ccc(Br)cn2)c1C#N	2	nM	8863804
CHEMBL37762	Fc1cccc(F)c1[C@H]2C[C@H]2NC(=O)Nc3ccc(Cl)cn3	2	nM	9873380
CHEMBL162118	CCN1c2nc(Cl)cc(C)c2NC(=O)c3cc(CSc4ccncc4)cnc13	2.2	nM	14741280
CHEMBL2407581	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCN(CC)CC)N(C)C1=O)C(C)C	2.5	nM	14643337
CHEMBL85110	CCC1=C(Sc2ccccc2)N(COCCOCc3ccccc3)C(=O)NC1=O	3	nM	7689109
CHEMBL398766	Cc1ccc(NC(=S)NCCc2c(F)cccc2F)nc1	3	nM	8523406
CHEMBL435600	COc1ccc(F)c(CC\N=C(/S)\Nc2ccc(cn2)C#N)c1C#N	3	nM	8863804
CHEMBL287317	COc1ccc(OC)c(CCNC(=O)Nc2ccc(Cl)cn2)c1F	3	nM	9873380
CHEMBL328258	COc1ccccc1C(=O)CC\N=C(/S)\Nc2ccc(Br)cn2	3	nM	10698450
CHEMBL91624	Fc1cccc(F)c1C(=O)CC\N=C(/S)\Nc2ccc(Br)cn2	3	nM	10698450
CHEMBL88840	Clc1ccc(NC(=S)NCCc2ccccc2)nc1	3	nM	10698450
CHEMBL56135	Cc1cc(Br)cc(c1)S(=O)(=O)c2cccc(N)c2C#N	3	nM	11384233
CHEMBL207512	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3Cl)C(=O)N	3	nM	16503141
CHEMBL207839	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccccc3[N+](=O)[O-]	3	nM	16503141
CHEMBL382553	Cc1c(Cl)cccc1n2nnnc2SCC(=O)Nc3ccccc3[N+](=O)[O-]	3	nM	16503141
CHEMBL381134	Cc1ccc(c(Br)c1)n2nnnc2SCC(=O)Nc3ccccc3[N+](=O)[O-]	3	nM	16503141
CHEMBL206522	NS(=O)(=O)c1ccc(NC(=O)CSc2nnnn2c3cc(Cl)ccc3Cl)c(Cl)c1	3	nM	16503141
CHEMBL134278	CCC(=O)c1ccc(F)c(C2CC2NC(=O)Nc3ccc(Cl)cn3)c1O	3.2	nM	10514285
CHEMBL253169	COCc1ccc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1F	4	nM	8863804
CHEMBL134630	Fc1ccoc1CC\N=C(/S)\Nc2ccc(Cl)cn2	4	nM	8863804
CHEMBL38318	CCOc1ccc(F)c([C@H]2C[C@H]2NC(=O)Nc3ccc(cn3)C#N)c1Cl	4	nM	9873380
CHEMBL91332	Fc1ccccc1C(=O)CC\N=C(/S)\Nc2ccc(Br)cn2	4	nM	10698450
CHEMBL205152	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-]	4	nM	16503141
CHEMBL379722	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3Cl)S(=O)(=O)N	4	nM	16503141
CHEMBL207929	[O-][N+](=O)c1ccccc1NC(=O)CSc2nnnn2c3cc(Cl)ccc3Cl	4	nM	16503141
CHEMBL206962	[O-][N+](=O)c1ccccc1NC(=O)CSc2nnnn2c3c(Cl)cccc3Cl	4	nM	16503141
CHEMBL421841	CCN1c2nccc(C)c2NC(=O)c3cc(CSc4cc(C)nc(C)c4)cnc13	4.2	nM	14741280
CHEMBL399976	CCOc1cccc(F)c1CCNC(=S)Nc2ccc(C)cn2	4.5	nM	8523406
CHEMBL400547	CCc1csc(NC(=S)NCCc2c(F)cccc2F)n1	5	nM	8523406
CHEMBL306904	CC1CN2C(=S)Nc3ccc(Cl)c(CN1CC=C(C)C)c23	5	nM	8667357
CHEMBL429488	CCOc1ccc(F)c(CCNC(=S)Nc2ccc(cn2)C#N)c1Cl	5	nM	8863804
CHEMBL399503	CCOc1ccc(OC)c(CCNC(=S)Nc2ccc(Cl)cn2)c1F	5	nM	8863804
CHEMBL253822	COc1ccc(OC)c(CCNC(=S)Nc2ccc(Cl)cn2)c1	5	nM	8863804
CHEMBL135259	CCOc1ccc(F)c(CC\N=C(/S)\N[n+]2ccc(Cl)cn2)c1Cl	5	nM	8863804
CHEMBL135254	COc1ccc(F)c(CC\N=C(/S)\Nc2ccc(Cl)cn2)c1C#N	5	nM	8863804
CHEMBL402265	CCOc1ccc(F)c(F)c1CCNC(=S)Nc2ccc(Br)cn2	5	nM	8863804
CHEMBL291983	Cc1cc(Cl)cc(c1)S(=O)(=O)c2cccc(N)c2C#N	5	nM	11384233
CHEMBL236161	CC(C1=C(C)C(=O)NC(=N1)SC2CCCC2)c3c(F)cccc3F	5	nM	14761194
CHEMBL207900	[O-][N+](=O)c1ccccc1NC(=O)CSc2nnnn2c3cccc4ccccc34	5	nM	16503141
CHEMBL377010	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccccc3Cl	5	nM	16503141
CHEMBL207920	CN(C)CCCNC(=O)c1ccc(NC(=O)CSc2nnnn2c3c(C)cc(C)cc3C)c(Cl)c1	5	nM	16503141
CHEMBL254007	Fc1cccc(F)c1CCNC(=S)Nc2nc(cs2)C#N	6	nM	8523406
CHEMBL252137	Fc1cccc(Cl)c1CCNC(=S)Nc2nccs2	6	nM	8523406
CHEMBL436546	CC(C)C1=C(Cc2ccccc2)N(COCc3ccccc3)C(=O)NC1=O	6	nM	8648598
CHEMBL253170	CCOc1ccc(F)c(CCNC(=S)Nc2ccc(Cl)cn2)c1Cl	6	nM	8863804
CHEMBL253369	CCOc1cccc(F)c1CCNC(=S)Nc2ccc(Br)cn2	6	nM	8863804
CHEMBL398890	COc1ccc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1F	6	nM	8863804
CHEMBL88710	Fc1cccc(F)c1C(=O)CC\N=C(/S)\Nc2ccc(Cl)cn2	6	nM	10698450
CHEMBL351728	CCN1c2nc(Cl)cc(C)c2NC(=O)c3cc(CSc4nc(C)cc(C)n4)cnc13	6	nM	14741280
CHEMBL162383	CCN1c2nc(F)cc(C)c2NC(=O)c3cc(CSc4cc(C)nc(C)c4)cnc13	6.9	nM	14741280
CHEMBL299001	Cc1cc(C)cc(c1)S(=O)(=O)c2cccc(N)c2C#N	7	nM	11384233
CHEMBL164261	CCN1c2nc(Cl)cc(C)c2NC(=O)c3cc(CSc4cc(C)nc(C)c4)cnc13	7	nM	14741280
CHEMBL381513	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccccc3Br	7	nM	16503141
CHEMBL83412	CCc1cc(NCc2cc(C)c(C)cc2OC)c(O)nc1C	8	nM	7678654
CHEMBL37025	CCOc1ccc(F)c([C@H]2C[C@H]2NC(=O)Nc3ccc(Cl)cn3)c1Cl	8	nM	9873380
CHEMBL35729	CCOc1ccc(OC)c(CCNC(=O)Nc2ccc(Cl)cn2)c1F	8	nM	9873380
CHEMBL593	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	8	nM	10514285
CHEMBL88729	Brc1ccc(NC(=S)N[C@@H]2C[C@@H]2c3ccccc3)nc1	8	nM	10698450
CHEMBL422371	CCN1c2ncc(CSc3oc4ccccc4n3)cc2C(=O)Nc5c(C)cc(Cl)nc15	8	nM	14741280
CHEMBL84621	CCc1cc(NCc2cc(C)c(C)nc2OC)c(O)nc1C	9	nM	7678654
CHEMBL436177	CCOc1ccc(Cl)c(CC\N=C(/S)\Nc2ccc(Br)cn2)c1F	9	nM	8863804
CHEMBL319224	Fc1ccc(C#N)c(F)c1CC\N=C(/S)\Nc2ccc(Cl)cn2	9	nM	8863804
CHEMBL383088	NS(=O)(=O)c1ccc(NC(=O)CSc2nnnn2c3cccc(Cl)c3Cl)c(Cl)c1	9	nM	16503141
CHEMBL78882	Clc1ccc2NC(=O)NC(C#Cc3occc3)(C4CC4)c2c1	9.2	nM	7520079
CHEMBL132425	CCC(=O)c1ccc(F)c(C2CC2NC(=O)Nc3ccc(cn3)C#N)c1O	9.7	nM	10514285
CHEMBL144035	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccc(O)cc4	10	nM	7490732
CHEMBL142837	CCN1c2ncccc2C(=O)Nc3c(C)cc(Cl)nc13	10	nM	7490732
CHEMBL144744	CCN1c2nc(cc(C)c2NC(=O)c3cccnc13)N(C)CCO	10	nM	7490732
CHEMBL438146	CCOc1cccc(F)c1CCNC(=S)Nc2nccs2	10	nM	8523406
CHEMBL250438	COc1cccc(F)c1CCNC(=S)Nc2nccs2	10	nM	8523406
CHEMBL252136	Fc1cccc(F)c1CCNC(=S)Nc2nccs2	10	nM	8523406
CHEMBL100056	CCN1c2ncc(CCc3cccc(N)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	10	nM	9685235
CHEMBL69855	C1CC1N2c3ncccc3C=Cc4cccnc24	10	nM	9873507
CHEMBL88397	Clc1ccccc1C(=O)CCNC(=S)Nc2ccc(Br)cn2	10	nM	10698450
CHEMBL55187	COc1cc(C)cc(c1)S(=O)(=O)c2cccc(N)c2C#N	10	nM	11384233
CHEMBL381888	CC1CN(C2C[C@H](CO)C(C2)N=[N+]=[N-])C(=O)NC1=O	10	nM	16137881
CHEMBL205764	[O-][N+](=O)c1ccccc1NC(=O)CSc2nnnn2c3cc(F)ccc3Cl	10	nM	16503141
CHEMBL81227	Clc1ccc2NC(=O)NC(C#Cc3ccccc3C#N)(C4CC4)c2c1	10.8	nM	7520079
CHEMBL79526	Clc1ccc2NC(=O)NC(C#Cc3nccs3)(C4CC4)c2c1	10.9	nM	7520079
CHEMBL171919	CCc1cc(SCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	11	nM	7683054
CHEMBL162272	CCN1c2ncc(CSc3ccncc3C)cc2C(=O)Nc4c(C)cc(Cl)nc14	11	nM	14741280
CHEMBL106783	Oc1ncccc1C(OCc2ccccc2)(C#Cc3ccccc3)C(F)(F)F	11.69	nM	11212098
CHEMBL320282	Oc1ncccc1C(OCc2ccccc2)(C#CC3CC3)C(F)(F)F	11.82	nM	11212098
CHEMBL309896	Clc1ccc2NC(=O)N[C@](C#Cc3ccccn3)(C4CC4)c2c1	12	nM	7520079
CHEMBL66155	CC1N(CC=C(C)C)CCN2C(=S)Nc3ccc(Cl)c1c23	12	nM	8667357
CHEMBL350538	Cc1cc(SCc2cnc3N(C4CC4)c5nc(Cl)cc(C)c5NC(=O)c3c2)cc(C)n1	12	nM	14741280
CHEMBL207105	[O-][N+](=O)c1ccccc1NC(=O)CSc2nnnn2c3cccc(Cl)c3Cl	12	nM	16503141
CHEMBL82764	[O-][N+](=O)c1ccccc1C#CC2(NC(=O)Nc3ccc(Cl)cc23)C4CC4	12.8	nM	7520079
CHEMBL368116	CCc1cc(CCc2oc3cccc(F)c3n2)c(S)nc1C	13	nM	7683054
CHEMBL326408	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3cncs3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C	13	nM	9719591
CHEMBL377820	CN(C)CCCOc1ccc(NC(=O)CSc2nnnn2c3c(C)cc(C)cc3C)c(Cl)c1	13	nM	16503141
CHEMBL99235	CCc1cc(CCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	14	nM	7683054
CHEMBL177271	CCc1cc(CCc2oc3c(F)ccc(F)c3n2)c(O)nc1C	14	nM	7683054
CHEMBL326513	COC(=O)N[C@@H](C(C)C)C(=O)NN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)Cc2ccc(cc2)c3cncs3	14	nM	9719591
CHEMBL134026	CCC(=O)c1ccc(F)c(C2CC2NC(=O)Nc3ccc(Br)cn3)c1O	14	nM	10514285
CHEMBL192231	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc5cc(ccc5c4)C(=O)O)cnc13	14	nM	16107158
CHEMBL336237	CCc1c(C)nc(O)c(N)c1Sc2cc(C)cc(C)c2	15	nM	7473595
CHEMBL175162	CCc1cc(CCc2oc3c(F)ccc(F)c3n2)c(S)nc1C	15	nM	7683054
CHEMBL176362	CCc1cc(CCc2oc3cccc(F)c3n2)c(O)nc1C	15	nM	7683054
CHEMBL39999	Brc1ccc(NC(=S)NCCc2ccccn2)nc1	15	nM	9873380
CHEMBL191163	CCN1c2ncc(CCOc3ccc(cc3C)C(=O)O)cc2C(=O)N(C)c4ccc(OC)nc14	15	nM	16107158
CHEMBL189942	CCN1c2nc(F)ccc2N(C)C(=O)c3cc(CCOc4ccc(cc4C)C(=O)O)cnc13	15	nM	16107158
CHEMBL315289	Cc1cc(C)cc(c1)[C@]23SCCN2C(=O)c4ccccc34	16	nM	7689109
CHEMBL326347	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(CCC(C)C)NC(=O)[C@@H](NC(=O)OC)C(C)C	16	nM	9719591
CHEMBL135105	CC(=O)c1ccc(F)c(C2CC2NC(=O)Nc3ccc(cn3)C#N)c1O	16	nM	10514285
CHEMBL133772	CCOC(=O)NCCC=C(c1cc(C)c(OC)c(c1)C(=O)OC)c2cc(C)c(OC)c(c2)C(=O)OC	16	nM	11708913
CHEMBL320379	Oc1ncccc1C(OCc2ccccc2)(\C=C\C3CC3)C(F)(F)F	16.68	nM	11212098
CHEMBL280541	C[C@H](Sc1nc(N)cc(Cl)n1)c2cc3ccoc3cn2	17	nM	9554867
CHEMBL192530	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(cc4C)C(=O)O)cnc13	17	nM	16107158
CHEMBL80064	Clc1ccc2NC(=O)NC(C#Cc3ccccc3)(C4CC4)c2c1	17.7	nM	7520079
CHEMBL325900	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3nccs3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C	18	nM	9719591
CHEMBL57995	Oc1ncc2c(F)c(F)ccc2n1	18	nM	10673109
CHEMBL192790	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(cc4Br)C(=O)O)cnc13	18	nM	16107158
CHEMBL382454	Cc1cccc(c1C)n2nnnc2SCC(=O)Nc3ccccc3[N+](=O)[O-]	18	nM	16503141
CHEMBL55445	CCN1C(=O)c2cccnc2Oc3cc(C)cc(C#N)c13	19	nM	1375293
CHEMBL268871	CCc1cc(NCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	19	nM	7678654
CHEMBL86109	CCc1cc(CNc2cc(CC)c(C)nc2O)c(OC)nc1C	19	nM	7678654
CHEMBL85947	CC(C)Sc1nc(O)c(C)c(n1)C(C)c2c(F)cccc2F	19	nM	11472208
CHEMBL189928	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(cc4CC)C(=O)O)cnc13	19	nM	16107158
CHEMBL189423	CCN1c2nc(C)ccc2N(C)C(=O)c3cc(CCOc4ccc(cc4C)C(=O)O)cnc13	19	nM	16107158
CHEMBL3038082	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](SCCN2CCCCC2)N(C)C1=O)C(C)C	19.5	nM	14643337
CHEMBL3038084	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCN(C)C(C)C)N(C)C1=O)C(C)C	19.5	nM	14643337
CHEMBL314012	CN1C(=O)Nc2ccc(Cl)cc2C1(C#Cc3ccccn3)C4CC4	19.6	nM	7520079
CHEMBL37803	CCc1cc(NCc2oc3c(C)ccc(C)c3n2)c(O)nc1C	20	nM	1279173
CHEMBL433489	CN1C(=O)c2cc(N)ccc2Oc3cc(C)cc(C)c13	20	nM	1375293
CHEMBL356744	CCN1c2nc(SC)cc(C)c2NC(=O)c3cccnc13	20	nM	7490732
CHEMBL145199	CCN1c2ncccc2C(=O)Nc3c(C)cc(F)nc13	20	nM	7490732
CHEMBL144326	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)N4CCCC4	20	nM	7490732
CHEMBL142659	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccc(N)nc4	20	nM	7490732
CHEMBL343007	Cc1cc(Cl)nc2N(C3CC3)c4ncccc4C(=O)Nc12	20	nM	7490732
CHEMBL3143101	NC(=O)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c3ncnc(N)c13	20	nM	7562946
CHEMBL83622	CCc1cc(CCc2oc3ccccc3n2)c(O)nc1C	20	nM	7678654
CHEMBL316796	S=C(NCCc1ccccc1)Nc2ccccn2	20	nM	8523406
CHEMBL100833	CCN1c2nc(F)ccc2N(C)C(=O)c3cc(CCc4ccncc4)cnc13	20	nM	9685235
CHEMBL101845	CCN1c2ncc(CCc3ccc4ccccc4c3)cc2C(=O)N(C)c5ccc(F)nc15	20	nM	9685235
CHEMBL103386	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CSc4ccccc4)cnc13	20	nM	9685236
CHEMBL333386	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccn3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C	20	nM	9719591
CHEMBL37835	CCOc1ccc(Cl)c([C@H]2C[C@H]2NC(=O)Nc3ccc(Cl)cn3)c1F	20	nM	9873380
CHEMBL338047	CCC1=C(C)NC(=O)C(=C1Cc2cc(C)cc(C)c2)N(C)C	20	nM	11052800
CHEMBL85946	CCC(C)Sc1nc(O)c(C)c(n1)C(C)c2c(F)cccc2F	20	nM	11472208
CHEMBL310803	CSc1nc(O)c(C)c(n1)C(C)c2c(F)cccc2F	20	nM	11472208
CHEMBL368084	O\C(=C/C(=O)c1nc[nH]n1)\c2oc(Cc3ccc(F)cc3)cc2	20	nM	15634005
CHEMBL212448	COC(=O)CCC\C=C(/c1cc(C)c2OC(=O)N(C)c2c1)\c3cc(C)c(OC)c(c3)C(=O)OC	20	nM	16913721
CHEMBL131643	CCOc1ccc(Cl)c(C2CC2NC(=O)Nc3ccc(Cl)cn3)c1F	21	nM	10514285
CHEMBL298607	COC(=O)c1cc(C)cc2Oc3ncccc3C(=O)N(C)c12	22	nM	1375293
CHEMBL326941	CCOC(=O)N[C@@H](C(C)C)C(=O)NN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)Cc2ccc(cc2)c3cncs3	22	nM	9719591
CHEMBL364043	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(CCC(=O)O)cc4C)cnc13	22	nM	16107158
CHEMBL204993	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3Cl)[N+](=O)[O-]	22	nM	16503141
CHEMBL2368773	COC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(=O)(C)O)n2cnc3C(=O)N(CC#C)C=Nc23	22.3	nM	12723951
CHEMBL339203	Cc1nc(O)c(NCc2oc3c(Cl)ccc(Cl)c3n2)cc1C=C	23	nM	1279173
CHEMBL56051	CN1C(=O)c2cccnc2Oc3cc(C)cc(c13)[N+](=O)[O-]	23	nM	1375293
CHEMBL87765	CCc1cc(NCc2cc(C)ccc2OC)c(O)nc1C	23	nM	7678654
CHEMBL304294	CC1N(CC=C(C)C)CCN2C(=S)Nc3cc(Cl)cc1c23	23	nM	8667357
CHEMBL29274	FC(F)(F)[C@]1(NC(=O)Nc2ccc(Cl)cc12)\C=C\C3CC3	23	nM	11378361
CHEMBL370699	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(CC(=O)O)cc4C)cnc13	23	nM	16107158
CHEMBL207527	Cc1ccc(Cl)cc1n2nnnc2SCC(=O)Nc3ccccc3[N+](=O)[O-]	23	nM	16503141
CHEMBL311996	Clc1ccc2NC(=O)NC(C#Cc3ccccn3)(C4CC4)c2c1	23.2	nM	7520079
CHEMBL172861	CCc1cc(CCc2oc3ccccc3n2)c(S)nc1C	24	nM	7683054
CHEMBL3038085	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCN(C)C(C)(C)C)N(C)C1=O)C(C)C	24	nM	14643337
CHEMBL106694	Oc1ncccc1C(Oc2cccc(Oc3ccccc3)c2)(C#CC4CC4)C(F)(F)F	24.34	nM	11212098
CHEMBL39665	CN(C)c1ccc(F)c(CCNC(=O)Nc2ccc(Br)cn2)c1F	25	nM	10514285
CHEMBL91473	Fc1ccc(F)c(c1)C(=O)CC\N=C(/S)\Nc2ccc(Br)cn2	25	nM	10698450
CHEMBL106997	Oc1ncccc1C(OCc2cccnc2)(C#CC3CC3)C(F)(F)F	25.56	nM	11212098
CHEMBL66350	CC1Cn2c(S)nc3cccc(CN1CC(=C)C)c23	26	nM	8667357
CHEMBL1163	COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccn3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C	26	nM	9719591
CHEMBL104349	Oc1ncccc1C(OCc2ccccn2)(C#CC3CC3)C(F)(F)F	26	nM	11212098
CHEMBL162629	CCN1c2nc(Cl)cc(C)c2NC(=O)c3cc(CSc4cncnc4)cnc13	26	nM	14741280
CHEMBL294171	CCN1C(=O)c2cc(N)cnc2Oc3cc(C)cc(C)c13	27	nM	1375293
CHEMBL115673	COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3nnn(C)n3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C	27	nM	9719591
CHEMBL133658	CCOc1ccc(Cl)c(C2CC2NC(=O)Nc3ccc(cn3)C#N)c1F	27	nM	10514285
CHEMBL327777	Brc1ccc(NC(=S)NCCC(=O)c2ccccc2)nc1	27	nM	10698450
CHEMBL162905	CCN1c2ncc(CSc3ccnc(C)c3)cc2C(=O)Nc4c(C)cc(Cl)nc14	27	nM	14741280
CHEMBL362936	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(C(=O)O)c5ccccc45)cnc13	27	nM	16107158
CHEMBL329720	CCc1cc(CCc2oc3c(C)ccc(C)c3n2)c(O)nc1C	28	nM	7683054
CHEMBL116229	CCC(C)[C@H](NC(=O)OC)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccn3)NC(=O)[C@@H](NC(=O)OC)C(C)C	28	nM	9719591
CHEMBL440860	CCN1C(=O)c2cccnc2Oc3cc(C)cc(C)c13	29	nM	1375293
CHEMBL174130	CCc1cc(CCc2oc3c(Cl)cccc3n2)c(S)nc1C	29	nM	7683054
CHEMBL324521	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccn3)NC(=O)[C@@H](NC(=O)OC)C(C)C	29	nM	9719591
CHEMBL2373969	OC(=C)C[C@H]1[C@@H](C(=O)O)[C@]23[C@H]4[C@@H]5c6c7c8[C@H]9[C@@H]%10[C@@H]%11[C@H]%12C%13=C%14C%15=C%11c%16c%10c%17c8c%18c6c%19c5c%20c%21c%22c(c%23C%24=C2c%25c([C@@H]%13[C@H]%24c%26c%14c%27c%15c%28c%16c%29c%17c%18c%30c%19c%21c%31c%30c%29c%28c%32c%27c(c%23%26)c%22c%31%32)c%12c9c7c4%25)[C@]3%20[C@@H]1C(=O)O	29	nM	15686922
CHEMBL53043	Nc1cccc(c1C#N)S(=O)(=O)c2ccc3ccccc3c2	29.51	nM	15916427
CHEMBL83825	CCc1cc(NCN2C(=O)c3ccccc3C2=O)c(O)nc1C	30	nM	1279173
CHEMBL301222	CN1C(=O)c2cc(N)ccc2Oc3cc(C)ccc13	30	nM	1375293
CHEMBL144522	CN1C(=O)c2cccnc2N(C3CC3)c4nc(Br)ccc14	30	nM	7490732
CHEMBL85446	Cc1cccc(c1)C23SCCN2C(=O)c4ccccc34	30	nM	7681480
CHEMBL174419	CCc1cc(CCc2oc3cccc(Cl)c3n2)c(S)nc1C	30	nM	7683054
CHEMBL172311	CCc1cc(CCc2oc3c(Cl)ccc(Cl)c3n2)c(S)nc1C	30	nM	7683054
CHEMBL398765	Cc1ccc(NC(=S)NCCc2ccccc2)nc1	30	nM	8523406
CHEMBL252135	COc1ccc(Br)cc1CCNC(=S)Nc2nccs2	30	nM	8523406
CHEMBL147749	S\C(=N/CCc1ccccc1N=[N+]=[N-])\Nc2nccs2	30	nM	8523406
CHEMBL103953	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccnc(C)c4)cnc13	30	nM	9685235
CHEMBL100981	CCN1c2ncc(CSc3ncccn3)cc2C(=O)N(C)c4ccc(Cl)nc14	30	nM	9685236
CHEMBL100445	CCN1c2ncc(COc3ccnc(C)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	30	nM	9685236
CHEMBL318002	CCN1c2ncc(COc3cc[n+]([O-])cc3)cc2C(=O)N(C)c4ccc(F)nc14	30	nM	9685236
CHEMBL416107	CCc1c(C)nc(O)c(c1Sc2cc(C)cc(C)c2)[N+](=O)[O-]	30	nM	11052800
CHEMBL55951	Nc1cccc(c1C#N)S(=O)(=O)c2cc(Cl)cc(Cl)c2	30	nM	11384233
CHEMBL309674	CC(C1=CC(=O)NC(=N1)SC2CCCC2)c3c(F)cccc3F	30	nM	14761194
CHEMBL366402	CC1=C(Cc2c(F)cccc2F)N=C(NC3CCCC3)NC1=O	30	nM	14761194
CHEMBL291763	CCN1C(=O)c2cccnc2Oc3cc(C)cc(c13)[N+](=O)[O-]	31	nM	1375293
CHEMBL114227	COC(=O)N[C@@H](C(C)C)C(=O)NN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)Cc2ccc(cc2)c3ccccn3	31	nM	9719591
CHEMBL85059	Cc1cc(C)cc(c1)S(=O)(=O)c2c([nH]c3ccc(Cl)cc23)C(=O)N	31	nM	12773052
CHEMBL205999	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccccc3I	31	nM	16503141
CHEMBL82798	CCc1ccc(OC)c(CNc2cc(CC)c(C)nc2O)c1	32	nM	7678654
CHEMBL36995	CCOCN1C(=O)NC(=O)C(=C1Sc2ccccc2)CC	32	nM	7678654
CHEMBL87676	CCc1cc(NCc2ccc(C)cc2OC)c(O)nc1C	32	nM	7678654
CHEMBL442013	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3cncs3)NC(=O)[C@@H](NC(=O)OC)C(C)C	32	nM	9719591
CHEMBL283619	FC(F)(F)[C@]1(NC(=O)Nc2ccc(Cl)cc12)C#CC3CC3	32	nM	11378361
CHEMBL83635	CCc1cc(CNc2cc(CC)c(C)nc2O)c(OC)cc1C	33	nM	7678654
CHEMBL177016	CCc1cc(CCc2oc3cccc(C)c3n2)c(O)nc1C	33	nM	7683054
CHEMBL114039	COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3nccs3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C	33	nM	9719591
CHEMBL84933	CCc1cc(NCc2cc3ccccc3nc2OC)c(O)nc1C	34	nM	7678654
CHEMBL176957	CCCc1cc(CCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	34	nM	7683054
CHEMBL69566	CC1Cn2c(S)nc3cc(Cl)cc(CN1CC4CC4)c23	34	nM	8667357
CHEMBL113943	CCOC(=O)N[C@@H](C(C)C)C(=O)NN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC)C(C)C)Cc2ccc(cc2)c3ccccn3	34	nM	9719591
CHEMBL430639	Cc1cccc(c1)[C@]23SCCN2C(=O)c4ccccc34	35	nM	7689109
CHEMBL332042	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccc3)NC(=O)[C@@H](NC(=O)OC)C(C)C	35	nM	9719591
CHEMBL608901	CCCCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	35	nM	10882373
CHEMBL3038081	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCN(C)C)N(C)C1=O)C(C)C	35	nM	14643337
CHEMBL368172	CC(C1=C(C)C(=O)NC(=N1)NC2CCCC2)c3c(F)cccc3F	35	nM	14761194
CHEMBL70629	CCN1c2ccc(C)c(C)c2N(C)C(=O)c3cccnc13	36	nM	1712395
CHEMBL105863	Oc1nc2ccccc2cc1C(OCc3ccccc3)(C#CC4CC4)C(F)(F)F	36.01	nM	11212098
CHEMBL367052	CCc1cc(CCc2oc3c(F)cccc3n2)c(O)nc1C	37	nM	7683054
CHEMBL307220	CCN1c2cccc(C)c2NC(=O)c3cccnc13	38	nM	1712395
CHEMBL337029	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@@H](O)[C@@H]1C)c5ccccc5	38	nM	7506311
CHEMBL171920	CCc1cc(CCc2oc3c(Cl)cccc3n2)c(O)nc1C	39	nM	7683054
CHEMBL64233	CC(C)C#C[C@@]1(NC(=O)Nc2ccc(F)cc12)C(F)(F)F	39	nM	10821714
CHEMBL2368774	COC[C@H]1O[C@H]([C@H](OC)[C@@H]1OP(=S)(C)O)n2cnc3C(=O)N(CC=C)C=Nc23	39	nM	12723951
CHEMBL55186	COc1cc(cc(c1)S(=O)(=O)c2cccc(N)c2C#N)C(F)(F)F	39.81	nM	15916427
CHEMBL129	CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)C(=O)NC1=O	40	nM	1527788
CHEMBL439943	CCN1c2cc(C)c(C)cc2N(C)C(=O)c3cccnc13	40	nM	1712395
CHEMBL344289	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4cocc4	40	nM	7490732
CHEMBL144851	CCN1c2nc(cc(C)c2NC(=O)c3cccnc13)N4CCC(O)C4	40	nM	7490732
CHEMBL314883	CCc1cc(NCc2cc3CCCc3cc2OC)c(O)nc1C	40	nM	7678654
CHEMBL313450	CCc1cc(NCc2nc3CCCc3cc2OC)c(O)nc1C	40	nM	7678654
CHEMBL176443	CCc1cc(CCc2oc3c(C)cccc3n2)c(O)nc1C	40	nM	7683054
CHEMBL254201	COc1ccccc1CCNC(=S)Nc2nccs2	40	nM	8523406
CHEMBL101946	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4cccc(N)c4)cnc13	40	nM	9685235
CHEMBL308907	CCN1c2ncccc2C=Cc3cccnc13	40	nM	9873507
CHEMBL462018	CN1N=C(N)c2cn([C@@H]3O[C@H](COP(=O)(O)O)[C@@H](O)[C@H]3O)c4ncnc1c24	40	nM	10882371
CHEMBL331237	CN1N=C(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c4ncnc1c24	40	nM	10882371
CHEMBL177201	CC(C1=CC(=O)NC(=N1)NC2CCCC2)c3c(F)cccc3F	40	nM	14761194
CHEMBL116165	COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3cncs3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C	41	nM	9719591
CHEMBL324601	CCN(CC)c1ccc(CN(C[C@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)cc1	41	nM	9719591
CHEMBL325343	CCc1cc(c(O)nc1C)C(OCc2c(Cl)cccc2Cl)(C#CC3CC3)C(F)(F)F	41.1	nM	11212098
CHEMBL125336	CCc1cc(NCc2oc3c(Cl)ccc(Cl)c3n2)c(S)nc1C	42	nM	1279173
CHEMBL303015	C[C@@H]1CN2C(=S)Nc3cccc([C@@H](C)N1CC=C(C)C)c23	42	nM	8667357
CHEMBL338263	CSc1cc(NCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	43	nM	1279173
CHEMBL291987	CCN1C(=O)c2cc(N)ccc2Oc3cc(C)cc(C)c13	43	nM	1375293
CHEMBL172583	CCc1cc(CCc2oc3c(F)cccc3n2)c(S)nc1C	43	nM	7683054
CHEMBL296092	CC1Cn2c(S)nc3cc(Cl)cc(CN1CC=C(C)C)c23	43	nM	8667357
CHEMBL3038083	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](SCCN(C)C(C)(C)C)N(C)C1=O)C(C)C	43	nM	14643337
CHEMBL322004	Oc1ncccc1C(OCc2ccccc2)(\C=C\c3ccccc3)C(F)(F)F	43.89	nM	11212098
CHEMBL280752	CC(Sc1nc(N)cc(Cl)n1)c2cc3ccoc3cn2	44	nM	9554867
CHEMBL56501	CC(C)N1C(=O)c2cc(N)cnc2Oc3cc(C)c(C)cc13	45	nM	1375293
CHEMBL300087	CCOC(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	45	nM	10937734
CHEMBL1269597	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](SCCN(C)C)N(C)C1=O)C(C)C	45	nM	14643337
CHEMBL56500	CN1C(=O)c2cc(N)cnc2Oc3cc(C)cc(C)c13	46	nM	1375293
CHEMBL420367	CC(=CCN1CCN2C(=S)Nc3ccc(Cl)c(C1)c23)C	46	nM	8667357
CHEMBL31977	CC1OC(\C=C\C2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	46	nM	11378361
CHEMBL431868	CC(C)c1c(O)nc(SCC(=O)c2ccccc2)nc1Cc3cccc4ccccc34	46	nM	15149669
CHEMBL313404	CCc1cc(NCc2nc3CCCCc3cc2OC)c(O)nc1C	47	nM	7678654
CHEMBL89195	Fc1ccc(cc1)C(=O)CC\N=C(/S)\Nc2ccc(Br)cn2	47	nM	10698450
CHEMBL3038090	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](SCCN(CC)CC)N(C)C1=O)C(C)C	47	nM	14643337
CHEMBL176594	CC(C)c1cc(CCc2oc3ccccc3n2)c(O)nc1C	48	nM	7683054
CHEMBL79338	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4c[nH]c5ccccc45	49	nM	9240358
CHEMBL54900	CN1C(=O)c2cc(ccc2Oc3cc(C)cc(C)c13)C#N	50	nM	1375293
CHEMBL105318	CC1=CN([C@H]2C[C@H](F)[C@@H](CO)O2)C(=O)NC1=O	50	nM	1527788
CHEMBL444314	CC1=CN([C@H]2CC[C@@H](CO)O2)C(=O)NC1=O	50	nM	1527788
CHEMBL444080	CCN1c2nc(OC)cc(CO)c2NC(=O)c3cccnc13	50	nM	7490733
CHEMBL400546	Cc1ccc(NC(=S)NCCc2ccccn2)nc1	50	nM	8523406
CHEMBL132756	COc1ccc(F)c(CC\N=C(/S)\Nc2ccc(Br)cn2)c1C#N	50	nM	8863804
CHEMBL398891	CCOc1ccc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1Cl	50	nM	8863804
CHEMBL334983	COc1ccc(F)c(F)c1CC\N=C(/S)\Nc2ccc(Br)cn2	50	nM	8863804
CHEMBL330416	CCN1c2ncc(CCc3ccnc(c3)C(=O)N)cc2C(=O)N(C)c4ccc(Cl)nc14	50	nM	9685235
CHEMBL102192	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4ccccc4)cnc13	50	nM	9685235
CHEMBL101412	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccccc4)cnc13	50	nM	9685235
CHEMBL100352	CCN1c2ncccc2N(C)C(=O)c3cc(CO)cnc13	50	nM	9685235
CHEMBL100980	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CSc4ccncc4)cnc13	50	nM	9685236
CHEMBL317180	CCN1c2ncc(CSc3[nH]cnc4nncc34)cc2C(=O)N(C)c5ccc(Cl)nc15	50	nM	9685236
CHEMBL123779	Cc1cccc(CSc2nc(N)cc(Cl)n2)c1	50	nM	9748354
CHEMBL83140	CC(C)SC1=NC(=C(C)C(=O)N1)Cc2c(F)cccc2F	50	nM	10052969
CHEMBL87393	CCC(C)Sc1nc(O)cc(Cc2c(F)cccc2F)n1	50	nM	10052969
CHEMBL87235	CCC(C)Sc1nc(O)c(C)c(Cc2c(F)cccc2F)n1	50	nM	10052969
CHEMBL303089	Fc1ccc2NC(=O)N[C@@](C#CC3CC3)(c2c1)C(F)(F)F	50	nM	10821714
CHEMBL87451	CC(C)SC1=NC(=CC(=O)N1)Cc2c(F)cccc2F	50	nM	11472208
CHEMBL38679	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3ccccc3	50	nM	11931611
CHEMBL266007	COC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccc3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C	51	nM	9719591
CHEMBL173575	CCc1cc(CCc2oc3c(C)ccc(C)c3n2)c(S)nc1C	52	nM	7683054
CHEMBL88966	Fc1ccccc1C(=O)CCNC(=O)Nc2ccc(Br)cn2	54	nM	10698450
CHEMBL62104	CCC#C[C@@]1(NC(=O)Nc2ccc(F)cc12)C(F)(F)F	54	nM	10821714
CHEMBL68137	Oc1c(Cl)ccc2NC(=O)NC(C#CC3CC3)(c12)C(F)(F)F	54	nM	11206461
CHEMBL208057	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3C)S(=O)(=O)N	54	nM	16503141
CHEMBL99992	CCc1cc(NCc2oc3c(C)cccc3n2)c(O)nc1C	55	nM	1279173
CHEMBL56052	CN1C(=O)c2cccnc2Oc3cc(C)cc(C#N)c13	55	nM	1375293
CHEMBL207746	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3C)C(=O)N	55	nM	16503141
CHEMBL123636	CCc1cc(NCc2oc3c(Cl)ccc(Cl)c3c2)c(O)nc1C	57	nM	1279173
CHEMBL56110	CN1C(=O)c2ccccc2Oc3cc(C)cc(C)c13	57	nM	1375293
CHEMBL124441	CCCc1cc(NCN2C(=O)c3ccccc3C2=O)c(O)nc1C	58	nM	1279172
CHEMBL125232	CCc1cc(N(C)Cc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	58	nM	1279173
CHEMBL176463	CCc1cc(CCC2=NC3CCCCC3O2)c(O)nc1C	58	nM	7683054
CHEMBL324108	COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3ccccc3)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C	58	nM	9719591
CHEMBL59458	Fc1ccc2NC(=O)N[C@@](C#CC3CC3)(c2c1Cl)C(F)(F)F	59	nM	10821714
CHEMBL292608	CCN1C(=O)c2cc(N)ccc2Oc3cccc(C)c13	60	nM	1375293
CHEMBL145237	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4cn[nH]c4	60	nM	7490732
CHEMBL422123	CN1C(=O)c2cccnc2N(C3CC3)c4nc(ccc14)c5cc[nH]c5	60	nM	7490732
CHEMBL254414	CCOc1cccc(CCNC(=S)Nc2nccs2)c1	60	nM	8523406
CHEMBL253994	Fc1ccccc1CCNC(=S)Nc2nccs2	60	nM	8523406
CHEMBL66434	CC1Cn2c(S)nc3cccc(CN1CC4CC4)c23	60	nM	8667357
CHEMBL100934	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4cccc(NC(=O)N)c4)cnc13	60	nM	9685235
CHEMBL100136	CCN1c2ncc(CCc3ccnc(C)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	60	nM	9685235
CHEMBL329728	CCN1c2ncc(CNc3cccc(N)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	60	nM	9685236
CHEMBL123959	CCN(CC)C(=O)\C=C\CSc1nc(N)cc(Cl)n1	60	nM	9748354
CHEMBL157741	CCC(C)Sc1nc(O)c(C)c(Cc2c(Cl)cccc2Cl)n1	60	nM	10052969
CHEMBL191502	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4cccc5c(cccc45)C(=O)O)cnc13	60	nM	16107158
CHEMBL70719	CCN1c2cc(Cl)c(Cl)cc2N(C)C(=O)c3cccnc13	62	nM	1712395
CHEMBL176972	CCc1cc(CCc2oc3cccc(Cl)c3n2)c(O)nc1C	62	nM	7683054
CHEMBL124279	Nc1cc(Cl)nc(SCc2ccc(Cl)c(Cl)c2)n1	62	nM	9748354
CHEMBL64722	Fc1cccc2NC(=O)N[C@@](C#CC3CC3)(c12)C(F)(F)F	62	nM	10821714
CHEMBL300608	CN1C(=O)c2cc(O)ccc2Oc3cc(C)cc(C)c13	63	nM	1375293
CHEMBL372241	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc5c(cccc5c4)C(=O)O)cnc13	63	nM	16107158
CHEMBL366017	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCOc4ccc(cc4C)C(=O)O)cnc13	64	nM	16107158
CHEMBL309462	Clc1ccc2NC(=O)NC(C#Cc3cccnc3)(C4CC4)c2c1	64.5	nM	7520079
CHEMBL339090	CCc1cc(NCc2oc3c(Cl)cccc3n2)c(O)nc1C	65	nM	1279173
CHEMBL82856	CCc1cc(CCc2cc(CC)c(C)nc2OC)c(O)nc1C	65	nM	7678654
CHEMBL3038087	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SC)N(C)C1=O)C(C)C	65.5	nM	14643337
CHEMBL60545	Fc1ccc2NC(=O)N[C@@](C#Cc3ccccn3)(c2c1F)C(F)(F)F	68	nM	10821714
CHEMBL436200	CCc1cc(NCc2oc3c(F)ccc(F)c3n2)c(O)nc1C	70	nM	1279173
CHEMBL343883	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4cccc(N)c4	70	nM	7490732
CHEMBL145322	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)N(C)C	70	nM	7490732
CHEMBL357221	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccc[nH]4	70	nM	7490732
CHEMBL79403	C[C@@H]1Cn2c(S)nc3cccc(CN1CC=C(C)C)c23	70	nM	7520079
CHEMBL3143102	NC(=S)c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2F)c3ncnc(N)c13	70	nM	7562946
CHEMBL315290	CCc1cc(NCc2nc(CC)c(C)cc2OC)c(O)nc1C	70	nM	7678654
CHEMBL46961	C[C@H]1CN2C(=S)Nc3cccc(CN1CC=C(C)C)c23	70	nM	7678654
CHEMBL85574	CCc1cc(NCc2nc(C)c(C)cc2OC)c(O)nc1C	70	nM	7678654
CHEMBL2092834	OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]1O[C@@H](C[C@H]1F)N2C=CC(=O)NC2=O	70	nM	9622545
CHEMBL102113	CCN1c2ncc(CCc3ccnc(N)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	70	nM	9685235
CHEMBL103808	CCN1c2ncc(C[S+]([O-])c3ccccc3)cc2C(=O)N(C)c4ccc(Cl)nc14	70	nM	9685236
CHEMBL99747	CCN1c2ncc(COc3ccnc(c3)C(F)(F)F)cc2C(=O)N(C)c4ccc(Cl)nc14	70	nM	9685236
CHEMBL156340	Cc1c(O)nc(SC2CCCCC2)nc1Cc3c(F)cccc3F	70	nM	10052969
CHEMBL133559	CC(=O)c1ccc(F)c(C2CC2NC(=O)Nc3ccc(Br)cn3)c1O	70	nM	10514285
CHEMBL66947	COc1c(Cl)ccc2NC(=O)NC(C#CC3CC3)(c12)C(F)(F)F	70	nM	11206461
CHEMBL144604	Oc1ccc(CC\N=C(/S)\Nc2ccc(Br)cn2)cc1	70	nM	11229762
CHEMBL3038089	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCO)N(C)C1=O)C(C)C	70	nM	14643337
CHEMBL173790	Fc1cccc(F)c1CC2=CC(=O)NC(=N2)NC3CCCC3	70	nM	14761194
CHEMBL293332	CCN1C(=O)c2cc(N)cnc2Oc3cc(C)c(C)cc13	71	nM	1375293
CHEMBL299334	CSCCN1C(=O)c2ccccc2Oc3nc(Cl)ccc13	72	nM	1375293
CHEMBL325271	COC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc2ccc(cc2)c3nnn(n3)C(C)(C)C)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)C(C)(C)C	72	nM	9719591
CHEMBL293037	FC(F)(F)[C@]1(NC(=O)Nc2cccc(Cl)c12)C#CC3CC3	72	nM	10821714
CHEMBL3038088	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCN2CCCCC2)N(C)C1=O)C(C)C	72	nM	14643337
CHEMBL292711	CCC#C[C@@]1(NC(=O)Nc2ccc(F)c(F)c12)C(F)(F)F	74	nM	10821714
CHEMBL62039	Fc1ccc2NC(=O)N[C@@](C#CC3CC3)(c2c1F)C(F)(F)F	74	nM	10821714
CHEMBL105859	COC(=O)CCC\C=C(\c1ccc(OC)c(OC)c1)/c2cc(C)c(OC)c(c2)C(=O)OC	74	nM	16162014
CHEMBL98159	CCc1cc(CCc2oc3ccccc3c2)c(O)nc1C	77	nM	1716683
CHEMBL65881	CC1N(CC=C(C)C)CCN2C(=S)Nc3cccc1c23	78	nM	8667357
CHEMBL64521	CC(C)C#C[C@@]1(NC(=O)Nc2ccc(F)c(Cl)c12)C(F)(F)F	78	nM	10821714
CHEMBL320078	Fc1cccc2NC(=O)OC(C#CC3CC3)(c12)C(F)(F)F	78	nM	15546736
CHEMBL57	Cc1ccnc2N(C3CC3)c4ncccc4C(=O)Nc12	80	nM	7490733
CHEMBL445136	CCNc1ccc(OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)cc1	80	nM	7490733
CHEMBL125446	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4cccc4	80	nM	7504733
CHEMBL1203237	Cl.CSc1ccc2c(C)nc(CCCCCCC(=O)c3ccccc3)n2n1	80	nM	7504733
CHEMBL254207	Cc1ccccc1CCNC(=S)Nc2nccs2	80	nM	8523406
CHEMBL321544	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4ccncc4)cnc13	80	nM	9685236
CHEMBL313998	COc1cccc(c1)C(=O)CC\N=C(/S)\Nc2ccc(Br)cn2	80	nM	10698450
CHEMBL417394	Fc1ccc2NC(=O)N[C@@](C#Cc3ccccn3)(c2c1Cl)C(F)(F)F	80	nM	10821714
CHEMBL309899	CC1=C(Cc2c(F)cccc2F)N=C(NC1=O)SC3CCCC3	80	nM	11472208
CHEMBL320969	[Na+].[Na+].[Na+].[Na+].CC1=CN([C@@H]2O[C@H](COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C=C2)C(=O)NC1=O	80	nM	12852759
CHEMBL3038086	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](SCCO)N(C)C1=O)C(C)C	80	nM	14643337
CHEMBL312874	Fc1cccc(F)c1CC2=CC(=O)NC(=N2)SC3CCCC3	80	nM	14761194
CHEMBL3038092	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCn2ccnc2)N(C)C1=O)C(C)C	80.5	nM	14643337
CHEMBL2114369	C[C@@H]1O[C@@](C#CC2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	82	nM	11378361
CHEMBL173589	CCCc1cc(CCc2oc3ccccc3n2)c(O)nc1C	83	nM	7683054
CHEMBL84900	Cc1cc(C)cc(c1)C23SCCN2C(=O)c4ccccc34	84	nM	7689109
CHEMBL317992	Fc1ccc2NC(=O)OC(C#CC3CC3)(c2c1F)C(F)(F)F	84	nM	10522695
CHEMBL2407585	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](SC)N(C)C1=O)C(C)C	84	nM	14643337
CHEMBL137111	COc1ccc(F)c(CC\N=C(/S)\Nc2ccc(Br)cn2)c1OC	85	nM	8863804
CHEMBL113824	COC(=O)N[C@@H](C(C)C)C(=O)NN(C[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)OC)C(C)(C)C)Cc2ccc(cc2)c3ccccc3	85	nM	9719591
CHEMBL339067	Nc1cc(Cl)nc(SCc2cc3OCOc3cc2Cl)n1	85	nM	9748354
CHEMBL176631	CCc1cc(OCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	88	nM	7683054
CHEMBL292188	CCN1C(=S)c2cccnc2Oc3cc(C)cc(C)c13	90	nM	1375293
CHEMBL144820	CN1C(=O)c2cccnc2N(C3CC3)c4nc(Cl)ccc14	90	nM	7490732
CHEMBL422659	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)n4cccc4	90	nM	7490732
CHEMBL341847	CCN1c2nc(NCCO)cc(C)c2NC(=O)c3cccnc13	90	nM	7490732
CHEMBL83632	Clc1ccc2C(=O)N3CCS[C@]3(c4ccccc4)c2c1	90	nM	7689109
CHEMBL400685	COc1cccc(OC)c1CCNC(=S)Nc2nccs2	90	nM	8523406
CHEMBL122343	CN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NC5CC5	90	nM	8809165
CHEMBL135179	Cn1cccc1CC\N=C(/S)\Nc2ccc(Cl)cn2	90	nM	8863804
CHEMBL101501	CCN1c2ncccc2N(C)C(=O)c3cc(CCC(=O)OC)cnc13	90	nM	9685235
CHEMBL318982	CCN1c2nc(I)ccc2N(C)C(=O)c3cc(CCc4ccncc4)cnc13	90	nM	9685235
CHEMBL262184	CCN1c2ncc(COc3ccc4[nH]ccc4c3)cc2C(=O)N(C)c5ccc(Cl)nc15	90	nM	9685236
CHEMBL330180	CCN1c2ncc(CSc3[nH]cnc4ncnc34)cc2C(=O)N(C)c5ccc(Cl)nc15	90	nM	9685236
CHEMBL37834	CCOc1ccc(OC)c([C@H]2C[C@H]2NC(=O)Nc3ccc(Br)cn3)c1F	90	nM	9873380
CHEMBL160869	CCCCSc1nc(O)c(C)c(Cc2c(F)cccc2F)n1	90	nM	10052969
CHEMBL156255	Oc1cc(Cc2c(F)cccc2F)nc(SC3CCCCC3)n1	90	nM	10052969
CHEMBL156637	CC(C)CSc1nc(O)c(C)c(Cc2c(F)cccc2F)n1	90	nM	10052969
CHEMBL303446	FC(F)(F)C12NC(=O)Nc3ccc(Cl)c(OC(=C1)C4CC4)c23	90	nM	11206461
CHEMBL312896	CCc1cc(CNc2cc(CC)c(C)nc2O)c(O)nc1C	91	nM	7678654
CHEMBL62179	CC(C)C#C[C@@]1(NC(=O)Nc2ccc(F)c(F)c12)C(F)(F)F	91	nM	10821714
CHEMBL125299	CCc1cc(NCc2oc3c(F)cccc3n2)c(O)nc1C	92	nM	1279173
CHEMBL37842	CCN1c2nccc(Cl)c2NC(=O)c3cccnc13	95	nM	11170624
CHEMBL2114370	C[C@@H]1O[C@@](C#CC2CC2)(c3cc(F)ccc3NC1=O)C(F)(F)F	95	nM	11378361
CHEMBL405301	CC[C@@H]1NC(=O)C([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)[C@@H](CO)N(C)C1=O)C(C)C	95	nM	14643337
CHEMBL193125	CCN1c2ncccc2N(C)C(=O)c3cc(CCOc4ccc(cc4)C(=O)O)cnc13	95	nM	16107158
CHEMBL174364	Cc1cc(CCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	97	nM	7683054
CHEMBL336807	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4CC	98	nM	10514284
CHEMBL1160260	CC1=CN([C@H]2C[C@@H](N=[N+]=[N-])[C@@H](OP(=O)(O)OP(=O)(O)NP(=O)(O)O)O2)C(=O)NC1=O	100	nM	1375962
CHEMBL140532	Cc1cc(C)cc(Sc2c(C)cnc(O)c2N)c1	100	nM	7473595
CHEMBL146550	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4ccsc4	100	nM	7490732
CHEMBL144653	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4cccc(O)c4	100	nM	7490732
CHEMBL357183	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4nccs4	100	nM	7490732
CHEMBL359195	Nc1ccc(OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)cc1	100	nM	7490733
CHEMBL125532	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4cncn4	100	nM	7504733
CHEMBL434441	Cc1cncn1c2ccc3c(C)nc(CCCCCCC(=O)c4ccccc4)n3n2	100	nM	7504733
CHEMBL254628	Cc1csc(NC(=S)NCCc2ccccc2)n1	100	nM	8523406
CHEMBL133195	Brc1ccc(NC(=S)NCCn2nc3ccccc3n2)nc1	100	nM	8863804
CHEMBL318635	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccc(C)cc4)cnc13	100	nM	9685235
CHEMBL317130	CCN1c2ncccc2N(C)C(=O)c3cc(N)cnc13	100	nM	9685235
CHEMBL433172	CCN1c2ncc(COc3cc[n+]([O-])c(C)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	100	nM	9685236
CHEMBL323072	CCN1c2ncc(CS(=O)(=O)c3ccccc3)cc2C(=O)N(C)c4ccc(Cl)nc14	100	nM	9685236
CHEMBL101091	CCN1c2ncc(COc3cccc(N)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	100	nM	9685236
CHEMBL40562	COc1ccc(C(=O)C)c(F)c1CCNC(=O)Nc2ccc(Cl)cn2	100	nM	9873380
CHEMBL154913	CCC(C)Sc1nc(O)cc(Cc2c(Cl)cccc2Cl)n1	100	nM	10052969
CHEMBL240416	COc1ccc(OC)c(CCNC(=S)Nc2ccc(Br)cn2)c1	100	nM	10636251
CHEMBL611850	CCCCCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	100	nM	10882373
CHEMBL128931	CCc1c(C)nc(O)c(N)c1C(=O)c2cc(C)cc(C)c2	100	nM	11052800
CHEMBL57733	CCc1c(C)nc(O)c(N)c1Cc2cc(C)cc(C)c2	100	nM	11052800
CHEMBL3038093	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](SCCN2CCOCC2)N(C)C1=O)C(C)C	101	nM	14643337
CHEMBL108154	CC(C)C#CC1(OC(=O)Nc2cccc(F)c12)C(F)(F)F	102	nM	10576692
CHEMBL305345	Fc1c(Cl)ccc2NC(=O)N[C@@](C#CC3CC3)(c12)C(F)(F)F	102	nM	10821714
CHEMBL124430	CCc1cc(N(C)Cc2oc3c(C)ccc(C)c3n2)c(O)nc1C	103	nM	1279173
CHEMBL122293	CCc1cc(NCc2oc3c(Cl)ccc(F)c3n2)c(O)nc1C	105	nM	1279173
CHEMBL104658	CCCOC(C#CC1CC1)(c2cc(CC)c(C)nc2O)C(F)(F)F	105	nM	11212098
CHEMBL49316	CC(C)OC(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	108	nM	10937734
CHEMBL29171	FC(F)(F)C1(OCC(=O)Nc2ccc(Cl)cc12)\C=C\C3CC3	108	nM	11378361
CHEMBL48628	COc1ccc2NC(=O)C(C#CC3CC3)(N(CC4CC4)c2c1)C(F)(F)F	109	nM	10937734
CHEMBL124786	CCc1cc(NCc2oc3cccc(F)c3n2)c(O)nc1C	110	nM	1279173
CHEMBL73672	CCN1c2nccc(CC)c2NC(=O)c3cccnc13	110	nM	1712395
CHEMBL356998	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4ocnc4	110	nM	7490732
CHEMBL144061	C=Cc1ccnc2N(C3CC3)c4ncccc4C(=O)Nc12	110	nM	7490733
CHEMBL319032	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4cccc(C)c4)cnc13	110	nM	9685235
CHEMBL319277	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4ccccc4)cnc13	110	nM	9685236
CHEMBL293894	CCC#C[C@@]1(NC(=O)Nc2ccc(Cl)cc12)C(F)(F)F	110	nM	10821714
CHEMBL39792	CCN1c2ncccc2C(=O)N(C)c3c(CC)ccnc13	110	nM	11170624
CHEMBL420519	Cc1nc(O)c(NCc2oc3c(Cl)ccc(Cl)c3n2)c4Cc14	113	nM	1279173
CHEMBL126634	COc1cc(NCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	115	nM	1279173
CHEMBL99018	CCc1cc(NCc2oc3cccc(C)c3n2)c(O)nc1C	120	nM	1279173
CHEMBL144642	O=C1Nc2c(COc3ccccc3)ccnc2N(C4CC4)c5ncccc15	120	nM	7490733
CHEMBL413252	CCN1c2ncc(COc3cc[n+]([O-])c(c3)C(F)(F)F)cc2C(=O)N(C)c4ccc(Cl)nc14	120	nM	9685236
CHEMBL294179	Nc1cccc(Sc2cc(Cl)cc(Cl)c2)c1C#N	120	nM	11384233
CHEMBL297897	CCOC(=O)N1c2cc(F)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	121	nM	10937734
CHEMBL93984	COc1cc(Cl)cc2c1NC(=O)OC2(C#CC3CC3)C(F)(F)F	122	nM	10522695
CHEMBL69005	FC(F)(F)C12NC(=O)Nc3ccc(Cl)c(OC(=C1)c4cccnc4)c23	122	nM	11206461
CHEMBL48376	COc1ccc2NC(=O)C(C#CC3CC3)(N(CC=C)c2c1)C(F)(F)F	123	nM	10937734
CHEMBL64467	COc1ccc2NC(=O)N[C@@](C#CC3CC3)(c2c1)C(F)(F)F	124	nM	10821714
CHEMBL295606	Fc1ccc2NC(=O)C(C#CC3CC3)(N(CC=C)c2c1)C(F)(F)F	124	nM	10937734
CHEMBL430601	Fc1ccc2NC(=O)N[C@@](C#Cc3ccccn3)(c2c1)C(F)(F)F	126	nM	10821714
CHEMBL324233	CCC#CC1(OC(=O)Nc2cccc(F)c12)C(F)(F)F	127	nM	10576692
CHEMBL299394	CCOC(=O)N1c2cc(Cl)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	127	nM	10937734
CHEMBL50550	FC(F)(F)C1(C#CC2CC2)N(CC3CC3)c4ccccc4NC1=O	127	nM	10937734
CHEMBL122284	CCCCc1cc(NCN2C(=O)c3ccccc3C2=O)c(O)nc1C	128	nM	1279172
CHEMBL302622	FC(F)(F)[C@]1(NC(=O)Nc2ccc(Cl)cc12)C#Cc3ccccn3	129	nM	10821714
CHEMBL107693	CCCCOC(C#CC1CC1)(c2cc(CC)c(C)nc2O)C(F)(F)F	129	nM	11212098
CHEMBL287650	CC1OC(\C=C\C2CC2)(c3cc(F)ccc3NC1=O)C(F)(F)F	129	nM	11378361
CHEMBL57113	FC(F)(F)[C@@]1(C#CC2CC2)[C@@H](OCc3ccncc3)C(=O)Nc4ccc(Cl)cc14	129	nM	11459666
CHEMBL53451	CCCN1C(=O)c2cc(N)ccc2Oc3cc(C)ccc13	130	nM	1375293
CHEMBL422798	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@H](O)[C@@H]1C)c5ccccc5	130	nM	7506311
CHEMBL310306	Clc1ccc2NC(=O)NC(C#Cc3ncccn3)(C4CC4)c2c1	130	nM	7520079
CHEMBL253171	CCOc1ccc(F)c(CCNC(=S)Nc2ccc(I)cn2)c1Cl	130	nM	8863804
CHEMBL101944	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4cccnc4)cnc13	130	nM	9685235
CHEMBL102034	CCN1c2nc(F)ccc2N(C)C(=O)c3cc(COc4ccncc4)cnc13	130	nM	9685236
CHEMBL340047	CCOc1ccc(F)c(C2CC2NC(=O)Nc3ccc(cn3)C#N)c1Cl	130	nM	10514285
CHEMBL431936	CC(C)OC(=O)N1c2cc(F)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	130	nM	10937734
CHEMBL293736	FC(F)(F)[C@]1(CC(=O)Nc2ccc(Cl)cc12)C#CC3CC3	130	nM	11459666
CHEMBL97653	COc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	131	nM	10522695
CHEMBL299495	CCN1C(=O)c2cccnc2Oc3cc(C)cc(N)c13	132	nM	1375293
CHEMBL432763	Cc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	133	nM	10522695
CHEMBL58596	CC(C)C#CC1(NS(=O)(=O)Nc2ccc(Cl)cc12)C(C)C	137	nM	10673109
CHEMBL442519	CC[C@@H]1NC(=O)C([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)(C)O)N(C)C(=O)CN(C)C1=O)C(C)C	137.5	nM	14643337
CHEMBL305996	COc1c(Cl)ccc2NC(=O)NC(C#Cc3cccnc3)(c12)C(F)(F)F	139	nM	11206461
CHEMBL74690	CCN1c2cc(ccc2N(C)C(=O)c3cccnc13)N=[N+]=[N-]	140	nM	1712395
CHEMBL145193	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4cccs4	140	nM	7490732
CHEMBL358292	O=C1Nc2c(Cc3ccccc3)ccnc2N(C4CC4)c5ncccc15	140	nM	7490733
CHEMBL83524	Clc1cccc(c1)C23SCCN2C(=O)c4ccccc34	140	nM	7689109
CHEMBL331911	CCN(C1CCN(CC1)C(=O)c2cc3cc(NC(=O)N4CCN(C)CC4)ccc3[nH]2)c5ncccc5NC(C)C	140	nM	8809165
CHEMBL327938	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4cccc(NS(=O)(=O)C)c4)cnc13	140	nM	9685235
CHEMBL340593	Nc1cc(Cl)nc(SCc2cccc(Br)c2)n1	140	nM	9748354
CHEMBL132491	COCc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	140	nM	10514284
CHEMBL292891	COc1cc(C)cc(Sc2cccc(N)c2C#N)c1	141.25	nM	15916427
CHEMBL304028	Fc1ccc2NC(=O)N[C@@](C#Cc3ccccc3)(c2c1)C(F)(F)F	143	nM	10821714
CHEMBL304938	COc1c(Cl)ccc2NC(=O)NC(C#Cc3ccccc3)(c12)C(F)(F)F	144	nM	11206461
CHEMBL293077	CCN1C(=O)c2cc(N)ccc2Oc3ccccc13	145	nM	1375293
CHEMBL420740	CC1N(CC=C(C)C)CCN2C(=O)Nc3ccc(Cl)c1c23	145	nM	8667357
CHEMBL299978	FC(F)(F)C1(C#CC2CC2)N(C(=O)OCC=C)c3ccccc3NC1=O	147	nM	10937734
CHEMBL124526	CCc1cc(NCc2oc3cccc(Cl)c3n2)c(O)nc1C	150	nM	1279173
CHEMBL144290	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4cccc(OC)c4	150	nM	7490732
CHEMBL2114381	CCN1c2cc(C)c(C)nc2N(C)C(=O)c3cc(N)cnc13	150	nM	7537334
CHEMBL87303	O=C1N2CCSC2(c3ccccc13)c4cccc5ccccc45	150	nM	7681480
CHEMBL315054	O=C1N2CCS[C@@]2(c3ccccc13)c4cccc5ccccc45	150	nM	7689109
CHEMBL400733	COc1cccc(CCNC(=S)Nc2nccs2)c1	150	nM	8523406
CHEMBL254413	[O-][N+](=O)c1ccccc1CCNC(=S)Nc2nccs2	150	nM	8523406
CHEMBL253995	Fc1cccc(CCNC(=S)Nc2nccs2)c1	150	nM	8523406
CHEMBL125715	CCCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NCC	150	nM	8809165
CHEMBL421210	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccc5ccccc5c4)cnc13	150	nM	9685235
CHEMBL101938	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4ccnc(c4)C(=O)OC)cnc13	150	nM	9685235
CHEMBL124494	Nc1cc(Cl)nc(SCc2ccc3ccccc3c2)n1	150	nM	9748354
CHEMBL288336	CCN1c2ncccc2C(=O)N(C)c3ccc(Cl)nc13	150	nM	11170624
CHEMBL2368775	COC[C@H]1O[C@H]([C@H](OC)[C@@H]1OP(=O)(C)O)n2cnc3C(=O)N(CC#C)C=Nc23	150	nM	12723951
CHEMBL30752	CCC1OC(\C=C\C2CC2)(c3cc(F)ccc3NC1=O)C(F)(F)F	151	nM	11378361
CHEMBL108750	CCCC#CC1(OC(=O)Nc2cccc(F)c12)C(F)(F)F	156	nM	15546736
CHEMBL144652	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4occc4	160	nM	7490732
CHEMBL307994	CC1N(CC=C(C)C)CCN2C(=O)Nc3cc(Cl)cc1c23	160	nM	8667357
CHEMBL69674	CC(=CCN1CCN2C(=S)Nc3cc(Cl)cc(C1)c23)C	160	nM	8667357
CHEMBL125203	CN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NC5(C)CC5	160	nM	8809165
CHEMBL318952	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4cccc(c4)N=[N+]=[N-])cnc13	160	nM	9685235
CHEMBL103946	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4cccc(c4)C(=O)O)cnc13	160	nM	9685236
CHEMBL334129	COc1cccc(CSc2nc(N)cc(Cl)n2)c1	160	nM	9748354
CHEMBL295893	CC(C)C(I)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	160	nM	10937734
CHEMBL297851	CC(C)OC(=O)N1c2cc(Cl)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	160	nM	10937734
CHEMBL59140	CCCN1C(=O)c2cc(N)ccc2Oc3cc(C)c(C)cc13	165	nM	1375293
CHEMBL377310	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3C)[N+](=O)[O-]	165	nM	16503141
CHEMBL59917	FC(F)(F)[C@]1(NC(=O)Nc2ccc(Cl)c(Cl)c12)C#CC3CC3	166	nM	10821714
CHEMBL50664	CC(=C)OC(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	169	nM	10937734
CHEMBL305965	CCN1c2ccc(Cl)cc2N(C)C(=O)c3cccnc13	170	nM	1712395
CHEMBL69894	CCN1c2cc(Cl)ccc2N(C)C(=O)c3cccnc13	170	nM	1712395
CHEMBL426396	Cc1cc(CCc2oc3ccccc3n2)c(O)nc1C	170	nM	7683054
CHEMBL252964	CCOc1ccc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1F	170	nM	8863804
CHEMBL316922	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4cccc(c4)[N+](=O)[O-])cnc13	170	nM	9685236
CHEMBL288305	CCN1c2ncccc2C(=O)N(C)c3ccc(C)nc13	170	nM	11170624
CHEMBL2114371	CC[C@@H]1O[C@@](C#CC2CC2)(c3cc(F)ccc3NC1=O)C(F)(F)F	171	nM	11378361
CHEMBL177256	CCc1cc(CCc2oc3cc(C)ccc3n2)c(O)nc1C	172	nM	7683054
CHEMBL281230	CC1OC(\C=C\C2CC2)(c3c(F)c(F)ccc3NC1=O)C(F)(F)F	173	nM	11378361
CHEMBL70077	Oc1c(Cl)ccc2NC(=O)NC(C#Cc3ccccc3)(c12)C(F)(F)F	174	nM	11206461
CHEMBL177191	CCc1cnc(O)c(CCc2oc3ccccc3n2)c1	177	nM	7683054
CHEMBL324572	CCOC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(CC2CCCCC2)NC(=O)[C@@H](NC(=O)OCC)C(C)C	177	nM	9719591
CHEMBL301370	CC[C@@H]1N(C(=O)OC(C)C)c2cc(F)ccc2NC1=O	179	nM	10937734
CHEMBL127564	CCc1cc(NCc2oc3cccc(OC)c3n2)c(O)nc1C	180	nM	1279173
CHEMBL301022	CN1C(=O)c2cc(N)ccc2Oc3ccccc13	180	nM	1375293
CHEMBL144773	CCN1c2nc(\C=C\C(=O)OC)ccc2N(C)C(=O)c3cccnc13	180	nM	7490732
CHEMBL145736	CN1C(=O)c2cccnc2N(C3CC3)c4nc(ccc14)c5cccnc5	180	nM	7490732
CHEMBL67675	CC1Cn2c(O)nc3cc(Cl)cc(CN1CC=C(C)C)c23	180	nM	8667357
CHEMBL254237	CCOc1ccc(OCC)c(CCNC(=S)Nc2ccc(Br)cn2)c1	180	nM	8863804
CHEMBL539427	Brc1ccc(NC(=N)N[C@@H]2C[C@@H]2c3ccccc3)nc1	180	nM	10698450
CHEMBL110625	Cc1c(O)nc(SCC(=O)c2ccc(F)cc2)nc1Cc3cccc4ccccc34	180	nM	15149669
CHEMBL302861	Fc1ccc2NC(=O)N[C@@](C#Cc3ccccc3)(c2c1F)C(F)(F)F	181	nM	10821714
CHEMBL131518	CCOC(=O)CCCC=C(c1cc(C)c(OC)c(c1)C(=O)OC)c2cc(C)c(OC)c(c2)C(=O)OC	181	nM	11708913
CHEMBL49733	CC(=C)OC(=O)N1c2cc(F)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	183	nM	10937734
CHEMBL321174	CCOC(C#CC1CC1)(c2cc(CC)c(C)nc2O)C(F)(F)F	183	nM	11212098
CHEMBL284065	CCC1OC(\C=C\C2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	185	nM	11378361
CHEMBL105400	CCc1cc(c(O)nc1C)C(OCC2CC2)(C#CC3CC3)C(F)(F)F	188	nM	11212098
CHEMBL124594	CSc1cc(NCc2oc3ccccc3n2)c(O)nc1C	190	nM	1279173
CHEMBL71311	CCN1c2ccc(C)cc2N(C)C(=O)c3cccnc13	190	nM	1712395
CHEMBL356779	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4ncc[nH]4	190	nM	7490732
CHEMBL2115336	CCN1c2cc(C)c(C)nc2N(C)C(=O)c3cccnc13	190	nM	7537334
CHEMBL82803	Clc1ccc2C(=O)N3CCSC3(c4ccccc4)c2c1	190	nM	7689109
CHEMBL102056	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccccn4)cnc13	190	nM	9685235
CHEMBL340381	Nc1cc(Cl)nc(SC\C=C\c2ccccc2)n1	190	nM	9748354
CHEMBL94725	Fc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	190	nM	10522695
CHEMBL174311	CCc1cc(OCc2oc3ccccc3n2)c(O)nc1C	191	nM	7683054
CHEMBL31771	CC1OC(C#CC2CC2)(c3c(F)c(F)ccc3NC1=O)C(F)(F)F	193	nM	11378361
CHEMBL111635	CC(C)C#CC1(OC(=O)Nc2ccc(cc12)[N+](=O)[O-])C(F)(F)F	199	nM	10576692
CHEMBL70483	CC(C)N1c2ccccc2N(C)C(=O)c3cccnc13	200	nM	1712395
CHEMBL358143	Cc1ccc(Cc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)c(O)c1	200	nM	7490733
CHEMBL337050	NC1=NC(=O)N(C=C1F)[C@H]2CS[C@@H](CO)C2	200	nM	7837220
CHEMBL145709	S=C(NCCc1ccccn1)Nc2nccs2	200	nM	8523406
CHEMBL401167	COc1ccc(OC)c(CCNC(=S)Nc2nccs2)c1	200	nM	8523406
CHEMBL254415	CCCOc1cccc(CCNC(=S)Nc2nccs2)c1	200	nM	8523406
CHEMBL254839	CC(C)c1csc(NC(=S)NCCc2ccccc2)n1	200	nM	8523406
CHEMBL148106	S=C(NCCc1ccccc1)Nc2nc(cs2)C#N	200	nM	8523406
CHEMBL147099	S=C(NCCc1ccccc1)Nc2nc3ccccc3s2	200	nM	8523406
CHEMBL398764	CCOC(=O)c1csc(NC(=S)NCCc2ccccc2)n1	200	nM	8523406
CHEMBL311356	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4c[nH]c5ccc(OC)cc45	200	nM	9240358
CHEMBL79339	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4c[nH]c5ncccc45	200	nM	9240358
CHEMBL322869	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccc(N)cc4)cnc13	200	nM	9685235
CHEMBL333128	CN(C)C(=O)\C=C\CSc1nc(N)cc(Cl)n1	200	nM	9748354
CHEMBL347823	CC(C)CSc1nc(O)cc(Cc2c(F)cccc2F)n1	200	nM	10052969
CHEMBL157028	CSc1nc(O)c(C)c(Cc2c(F)cccc2F)n1	200	nM	10052969
CHEMBL345190	CCCCSc1nc(O)cc(Cc2c(F)cccc2F)n1	200	nM	10052969
CHEMBL338936	CCC1=C(C)NC(=O)C(=C1Cc2cc(C)cc(C)c2)NC=O	200	nM	11052800
CHEMBL54600	Cc1cccc(c1)S(=O)(=O)c2cccc(N)c2C#N	200	nM	11384233
CHEMBL293989	Nc1cccc(c1C#N)S(=O)(=O)c2cccc(Br)c2	200	nM	11384233
CHEMBL83401	CSc1nc(O)cc(n1)C(C)c2c(F)cccc2F	200	nM	11472208
CHEMBL281913	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)OP(=O)(O)O)C=C3	200	nM	11881997
CHEMBL41694	Cc1ccccc1C(OCCn2c(C)ncc2[N+](=O)[O-])c3ccccc3	200	nM	11931611
CHEMBL381286	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3cccc(c3)[N+](=O)[O-]	200	nM	16503141
CHEMBL176637	CCc1cc(c(O)nc1C)S(=O)(=O)Cc2oc3c(Cl)ccc(Cl)c3n2	205	nM	7683054
CHEMBL321847	[O-][N+](=O)c1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	209	nM	10576692
CHEMBL294211	CCCN1C(=O)c2ccccc2Oc3nc(Cl)ccc13	210	nM	1375293
CHEMBL135808	CN(C)c1ccc(CC\N=C(/S)\Nc2ccc(Br)cn2)c(F)c1C#N	210	nM	8863804
CHEMBL318646	CCN1c2ncccc2N(C)C(=O)c3cc(CCC#N)cnc13	210	nM	9685235
CHEMBL99644	CCN1c2ncc(COc3ccc(O)cc3)cc2C(=O)N(C)c4ccc(Cl)nc14	210	nM	9685236
CHEMBL101293	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(cnc13)N(C)C(=O)c4ccccc4	210	nM	9685236
CHEMBL123504	Cc1cc(NCN2C(=O)c3ccccc3C2=O)c(O)nc1C	218	nM	1279172
CHEMBL291662	COc1ccc2NC(=O)N[C@@](C#Cc3ccccc3)(c2c1)C(F)(F)F	219	nM	10821714
CHEMBL84705	COC(=O)[C@H]1CSC2(N1C(=O)c3ccccc23)c4ccccc4	220	nM	7689109
CHEMBL125478	CCN(C1CCN(CC1)C(=O)c2cc3cc(NC(=O)N4CCN(C)CC4)ccc3[nH]2)c5ncccc5NC(C)(C)C	220	nM	8809165
CHEMBL308248	CCN1c2cc(ccc2N(C)C(=O)c3cccnc13)C(F)(F)F	230	nM	1712395
CHEMBL308686	CCCN1c2ccccc2N(C)C(=O)c3cccnc13	230	nM	1712395
CHEMBL121820	Cc1nc(CCCCCCC(O)c2ccccc2)n3nc(ccc13)n4ccnc4	230	nM	7504733
CHEMBL304826	C[C@@H]1Cn2c(O)nc3cc(Cl)cc([C@H](C)N1CC=C(C)C)c23	230	nM	8667357
CHEMBL436392	CC(C)Nc1cccnc1N(C2CC2)C3CCN(CC3)C(=O)c4cc5cc(NS(=O)(=O)C)ccc5[nH]4	230	nM	8809165
CHEMBL341201	Clc1ccc(NC(=S)NCCN2C(=O)c3c(Cl)ccc(Cl)c3C2=O)nc1	230	nM	8863804
CHEMBL101670	CCN1c2ncc(CCc3ccc(C)cc3)cc2C(=O)N(C)c4ccc(Cl)nc14	230	nM	9685235
CHEMBL319425	CCN1c2ncc(COc3cc[n+]([O-])cc3)cc2C(=O)N(C)c4ccc(Cl)nc14	230	nM	9685236
CHEMBL204735	[O-][N+](=O)c1ccccc1NC(=O)CSc2nnnn2c3ccc(Cl)c(Cl)c3	230	nM	16503141
CHEMBL129835	CCOC(=O)CCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	233	nM	11708913
CHEMBL316785	CCc1cc(NCc2oc3ccccc3c2)c(O)nc1C	235	nM	1716683
CHEMBL31285	FC(F)(F)CC1OC(C#CC2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	235	nM	11378361
CHEMBL292790	COc1ccc2NC(=O)N[C@@](C#Cc3ccccn3)(c2c1)C(F)(F)F	237	nM	10821714
CHEMBL55391	CCN1C(=O)c2cc(N)ccc2Oc3ccc(C)cc13	240	nM	1375293
CHEMBL305521	CCN1c2cccc(C)c2N(C)C(=O)c3cccnc13	240	nM	1712395
CHEMBL70850	CCN1c2nc(C)c(C)cc2N(C)C(=O)c3cccnc13	240	nM	1712395
CHEMBL145796	CCN1c2nc(OC)cc(C=O)c2NC(=O)c3cccnc13	240	nM	7490733
CHEMBL340822	CCCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NC(C)C	240	nM	8809165
CHEMBL262633	CCNc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NC(=O)N5CCN(C)CC5)ccc4[nH]3	240	nM	8809165
CHEMBL125112	CCNc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)N5CCN(C)CC5)ccc4[nH]3	240	nM	8809165
CHEMBL398837	CCOc1c(Cl)cc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1Cl	240	nM	8863804
CHEMBL36424	CCOc1ccc(F)c(CCNC(=O)Nc2ccc(Br)cn2)c1Cl	240	nM	9873380
CHEMBL108647	CC(C)c1c(O)nc(SCC(=O)c2ccc(C)cc2C)nc1Cc3cccc4ccccc34	240	nM	15149669
CHEMBL294720	Nc1ccc(CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F)cc1F	241	nM	11459666
CHEMBL68353	FC(F)(F)C12NC(=O)Nc3ccc(Cl)c(OC(=C1)c4ccccc4)c23	244	nM	11206461
CHEMBL2115317	C[C@H]1O[C@@](C#CC2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	249	nM	11378361
CHEMBL56383	CN1C(=O)c2cc(N)cnc2Oc3cc(C)ccc13	250	nM	1375293
CHEMBL335193	NC1=NC(=O)N(C=C1F)[C@@H]2CC[C@H](CO)S2	250	nM	7837220
CHEMBL329653	CCC1(Oc2ccccc2n3cccc3C1=O)c4ccccc4	250	nM	8709096
CHEMBL607723	CCCCCCCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	250	nM	10882373
CHEMBL124726	CCc1cc(NCc2oc3c(CC)cccc3n2)c(O)nc1C	260	nM	1279173
CHEMBL57697	CCCN1C(=O)c2cc(N)ccc2Oc3cccc(C)c13	260	nM	1375293
CHEMBL99624	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4ccncc4)cnc13	260	nM	9685236
CHEMBL441072	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4cccnc4)cnc13	260	nM	9685236
CHEMBL336426	CCOc1ccc(F)c(C2CC2NC(=O)Nc3cc(Cl)cnn3)c1Cl	260	nM	10514285
CHEMBL108581	CCc1c(O)nc(SCC(=O)c2ccc(Cl)cc2)nc1Cc3cccc4ccccc34	260	nM	15149669
CHEMBL299073	Fc1ccc2NC(=O)C(C#CC3CC3)(N(CC4CC4)c2c1)C(F)(F)F	263	nM	10937734
CHEMBL314061	CCc1cc(NCc2ccccc2OC)c(O)nc1C	265	nM	7678654
CHEMBL341667	O=C1Nc2c(COCc3ccccc3)ccnc2N(C4CC4)c5ncccc15	270	nM	7490733
CHEMBL341512	CN(C)c1ccc2c(C)nc(CCCCCCC(=O)c3ccccc3)n2n1	270	nM	7504733
CHEMBL82481	Clc1ccc2NC(=O)NC(C#Cc3cnccn3)(C4CC4)c2c1	270	nM	7520079
CHEMBL99896	CN(C)c1cc(F)c(CC\N=C(/S)\Nc2ccc(Cl)cn2)c(F)c1	270	nM	8863804
CHEMBL38341	COc1ccc(OC)c([C@H]2C[C@H]2NC(=O)Nc3ccc(Cl)cn3)c1F	270	nM	9873380
CHEMBL612013	CCN(CC)CC.NC1=NC(=O)N(C=C1F)[C@@H]2C[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C=C2	270	nM	10072683
CHEMBL132883	CCCc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	270	nM	10514284
CHEMBL109184	CCC#CC1(OC(=O)Nc2ccc(cc12)[N+](=O)[O-])C(F)(F)F	276	nM	15546736
CHEMBL291400	FC(F)(F)[C@]1(NC(=O)Nc2ccc(Cl)cc12)C#Cc3ccccc3	277	nM	10821714
CHEMBL338992	CCc1cc(NCc2oc3CCCCc3n2)c(O)nc1C	280	nM	1279173
CHEMBL56628	CN1C(=O)c2cc(ccc2Oc3cc(C)ccc13)C#N	280	nM	1375293
CHEMBL2115325	CCN1c2cccnc2N(C)C(=O)c3cc(N)cnc13	280	nM	7537334
CHEMBL85850	O=C1N2CCS[C@]2(c3ccccc3)c4ccccc14	280	nM	7689109
CHEMBL317080	CCN1c2ncc(COc3ccc(F)cc3)cc2C(=O)N(C)c4ccc(Cl)nc14	280	nM	9685236
CHEMBL339354	Nc1cc(nc(SCc2ccc3ccccc3c2)n1)C(F)(F)F	280	nM	9748354
CHEMBL416853	CC(C)C#C[C@@]1(NC(=O)Nc2ccc(Cl)cc12)C(F)(F)F	281	nM	10821714
CHEMBL129094	NC1=NC(=O)N(C=C1)[C@@H]2CC[C@H](CO)S2	287	nM	7837220
CHEMBL70255	CCN1c2cc(cc(Cl)c2N(C)C(=O)c3cccnc13)C(F)(F)F	290	nM	1712395
CHEMBL144872	Cc1ccccc1OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23	290	nM	7490733
CHEMBL2115328	CN1C(=O)c2cccnc2N(C3CC3)c4ncc(Cl)cc14	290	nM	7537334
CHEMBL82630	Clc1cccc2C(=O)N3CCSC3(c4ccccc4)c12	290	nM	7689109
CHEMBL103706	Fc1cc(F)c(CC\N=C(/S)\Nc2ccc(Cl)cn2)c(F)c1	290	nM	8863804
CHEMBL99793	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4cccc(OC)c4)cnc13	290	nM	9685236
CHEMBL3038091	CC[C@H](C)C[C@@H]1N(C)C(=O)CN(C)C(=O)[C@H](CC)NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC1=O)C(C)C	293	nM	14643337
CHEMBL124149	CC(=O)c1cc(NCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	300	nM	1279173
CHEMBL124557	CCc1cc(NCc2ccc3ccccc3c2)c(S)nc1C	300	nM	1279173
CHEMBL357411	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)N4CCCCC4	300	nM	7490732
CHEMBL100844	CCN1c2ncccc2N(C)C(=O)c3cc(CCCO)cnc13	300	nM	9685235
CHEMBL102166	CCN1c2ncccc2N(C)C(=O)c3cc(COc4ccncc4)cnc13	300	nM	9685236
CHEMBL157137	CCC(C)Sc1nc(O)cc(Cc2cccc(c2)[N+](=O)[O-])n1	300	nM	10052969
CHEMBL155689	CCC(C)Sc1nc(O)cc(Cc2ccccc2F)n1	300	nM	10052969
CHEMBL347403	CCC(C)Sc1nc(O)cc(Cc2ccccc2[N+](=O)[O-])n1	300	nM	10052969
CHEMBL294840	COC(=O)CCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	300	nM	10579849
CHEMBL538904	NC1=Nc2c(ncn2C3CC(OCP(=O)(O)OP(=O)(O)OP(=O)(O)O)C=C3)C(=O)N1	300	nM	11881997
CHEMBL39021	Cc1cccc(c1)C(OCCn2c(C)ncc2[N+](=O)[O-])c3ccccc3	300	nM	11931611
CHEMBL40632	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3cccc(c3)[N+](=O)[O-]	300	nM	11931611
CHEMBL301055	Nc1cccc(c1C#N)S(=O)(=O)c2cc(Cl)ccc2Cl	302	nM	15916427
CHEMBL110048	CCCC#CC1(OC(=O)Nc2ccc(cc12)[N+](=O)[O-])C(F)(F)F	304	nM	10576692
CHEMBL144866	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)n4cccn4	310	nM	7490732
CHEMBL174953	Cc1nc(O)c(CCc2oc3ccccc3n2)cc1C#N	310	nM	7683054
CHEMBL46008	CC(=C)OC(=O)N1c2cc(Cl)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	315	nM	10937734
CHEMBL355918	CN1C(=O)c2cccnc2N(C3CC3)c4nc(ccc14)c5ccncc5	320	nM	7490732
CHEMBL81319	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4cc[nH]c4	320	nM	9240358
CHEMBL316773	CC(C)c1c(O)nc(SCC(=O)c2ccc(Cl)cc2)nc1Cc3cccc4ccccc34	320	nM	15149669
CHEMBL418104	CN1C(=O)c2cc(N)cnc2Oc3cc(C)c(C)cc13	322	nM	1375293
CHEMBL49531	FC(F)(F)C1(C#CC2CC2)N(CC3CC3)c4cc(Cl)ccc4NC1=O	329	nM	10937734
CHEMBL342342	CCN1c2nc(cc(C=O)c2NC(=O)c3cccnc13)c4cccc(OC)c4	330	nM	7490733
CHEMBL100951	CCN1c2ncc(COc3cccc4[nH]ccc34)cc2C(=O)N(C)c5ccc(Cl)nc15	330	nM	9685236
CHEMBL125928	COC(=O)c1cccc(CSc2nc(N)cc(Cl)n2)c1	330	nM	9748354
CHEMBL123553	CCc1cc(NCc2oc3c(Cl)cccc3c2)c(O)nc1C	335	nM	1279173
CHEMBL125510	CCc1cc(NCc2cnc3ccccc3c2)c(O)nc1C	338.84	nM	8831772
CHEMBL56567	CC(C)N1C(=O)c2ccccc2Oc3ccccc13	340	nM	1375293
CHEMBL125205	Clc1ccc2cnc(CCCCCCC(=O)c3ccccc3)n2n1	340	nM	7504733
CHEMBL101979	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4cccc(c4)C(=O)N)cnc13	340	nM	9685236
CHEMBL48286	FC(F)(F)C1(C#CC2CC2)N(CCC3CC3)c4ccccc4NC1=O	340	nM	10937734
CHEMBL293785	CCN1C(=O)c2cccnc2Oc3cccc(c13)[N+](=O)[O-]	343	nM	1375293
CHEMBL431274	CCc1cc(NCc2nc3ccccc3s2)c(O)nc1C	346.74	nM	8831772
CHEMBL306032	CCN1c2ccccc2N(C)C(=O)c3cccnc13	350	nM	1712395
CHEMBL85142	CCOc1ccccc1CNc2cc(CC)c(C)nc2O	350	nM	7678654
CHEMBL399069	CCCc1csc(NC(=S)NCCc2ccccc2)n1	350	nM	8523406
CHEMBL254206	COc1ccc(CCNC(=S)Nc2nccs2)cc1	350	nM	8523406
CHEMBL100903	CCN1c2ncc(COc3ccccc3O)cc2C(=O)N(C)c4ccc(Cl)nc14	350	nM	9685236
CHEMBL611245	CCCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	350	nM	10882373
CHEMBL132049	NC1=NC(=O)N(C=C1)[C@H]2CS[C@@H](CO)C2	355	nM	7837220
CHEMBL340869	CCOC(=O)CCCC=C(c1cc(Br)c(OC)c(c1)C(=O)OC)c2cc(Br)c(OC)c(c2)C(=O)OC	359	nM	11708913
CHEMBL309574	CCN1c2ncccc2N(C(=O)C)C(=O)c3cccnc13	360	nM	1712395
CHEMBL121827	CC(C)Nc1ccc(Cl)nc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	360	nM	8809165
CHEMBL330602	CCN1c2ncc(CCc3ccc(N)cc3)cc2C(=O)N(C)c4ccc(Cl)nc14	360	nM	9685235
CHEMBL127283	CCNc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	360	nM	10514284
CHEMBL95426	CCc1cc(CCc2nc3ccccc3s2)c(O)nc1C	370	nM	1716683
CHEMBL331790	CC(C)Nc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccc(CO)cc4[nH]3	370	nM	8809165
CHEMBL102960	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4cccc(F)c4)cnc13	370	nM	9685235
CHEMBL320663	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CNc4ccccc4)cnc13	370	nM	9685236
CHEMBL107606	COc1ccc(cc1)C(=O)CSc2nc(O)c(C)c(Cc3cccc4ccccc34)n2	370	nM	15149669
CHEMBL56451	CCCN1C(=O)c2ccccc2Oc3ccccc13	375	nM	1375293
CHEMBL70312	CCN1C(=O)c2cccnc2N(CC)c3ccccc13	380	nM	1712395
CHEMBL73845	CCN1c2ccccc2NC(=O)c3cccnc13	380	nM	1712395
CHEMBL125084	Cc1nc(CCCCCCC(O)c2ccccc2)n3nc(Cl)ccc13	380	nM	7504733
CHEMBL340556	CCNc1cccnc1N(C(C)C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	380	nM	8809165
CHEMBL611745	CCN(CC)CC.NC1=NC(=O)N(C=C1)C2CC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C=C2	380	nM	10072683
CHEMBL58542	CCCCCC=C(c1cc(Br)c(OC)c(c1)C(=O)OC)c2cc(Br)c(OC)c(c2)C(=O)OC	380	nM	11708913
CHEMBL81441	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4c[nH]c5cnccc45	384	nM	9240358
CHEMBL173635	CCc1cc(CCc2oc(cn2)c3ccccc3)c(O)nc1C	385	nM	7683054
CHEMBL144561	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccn[nH]4	390	nM	7490732
CHEMBL315990	Cc1ccc(cc1C)C23SCCN2C(=O)c4ccccc34	390	nM	7689109
CHEMBL328168	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(NCc4ccccc4)cnc13	390	nM	9685236
CHEMBL285510	CCC1OC(C#CC2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	391	nM	11378361
CHEMBL291532	Nc1cccc(c1C#N)S(=O)(=O)c2cccc(Cl)c2	398.11	nM	15916427
CHEMBL55258	CCCN1C(=O)c2ccccc2Sc3ccccc13	400	nM	1375293
CHEMBL71927	CCN1c2cc(ccc2N(C)C(=O)c3cccnc13)[N+](=O)[O-]	400	nM	1712395
CHEMBL37067	CC1=C(Sc2ccccc2)N(COCc3ccccc3)C(=O)NC1=O	400	nM	7473595
CHEMBL341931	CCc1c(C)nc(O)cc1Sc2cc(C)cc(C)c2	400	nM	7473595
CHEMBL145295	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)N4CCOCC4	400	nM	7490732
CHEMBL83641	CCc1cc(CCc2cc(CC)c(C)nc2O)c(O)nc1C	400	nM	7678654
CHEMBL254416	CC(C)Oc1cccc(CCNC(=S)Nc2nccs2)c1	400	nM	8523406
CHEMBL356611	CCCOC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2N	400	nM	8558522
CHEMBL299714	CCOC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2N	400	nM	8558522
CHEMBL340453	CCNc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)CC)ccc4[nH]3	400	nM	8809165
CHEMBL155483	Oc1cc(Cc2c(Cl)cccc2Cl)nc(SC3CCCC3)n1	400	nM	10052969
CHEMBL351121	CCC(C)Sc1nc(O)c(C)c(Cc2cccc(c2)[N+](=O)[O-])n1	400	nM	10052969
CHEMBL349806	Oc1cc(Cc2c(Cl)cccc2Cl)nc(SC3CCCCC3)n1	400	nM	10052969
CHEMBL155864	CCC(C)Sc1nc(O)c(C)c(Cc2ccccc2Cl)n1	400	nM	10052969
CHEMBL611744	CCN(CC)CC.NC1=NC(=O)N(C=C1F)C2CC(COP(=O)(O)OP(=O)(O)OP(=O)(O)O)C=C2	400	nM	10072683
CHEMBL93822	Brc1ccc(NC(=S)NCCC2=CCCCC2)nc1	400	nM	10509923
CHEMBL331330	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NC(C)C	400	nM	10514284
CHEMBL170942	COc1cccc(CC\N=C(/S)\Nc2ccc(Br)cn2)c1	400	nM	10636251
CHEMBL91942	CCOc1ccc(F)c(CC\N=C(/N)\Nc2ccc(Br)cn2)c1Cl	400	nM	10698450
CHEMBL55997	CCCCOc1cc(C)cc(c1)S(=O)(=O)c2cccc(N)c2C#N	400	nM	11384233
CHEMBL86015	CC(c1cc(O)nc(SC2CCCC2)n1)c3cccc4ccccc34	400	nM	11472208
CHEMBL43293	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3ccccc3F	400	nM	11931611
CHEMBL60513	COc1ccc2NC(=O)N[C@@](C#CC(C)C)(c2c1)C(F)(F)F	401	nM	10821714
CHEMBL300721	CC(C)CN1c2cc(Cl)ccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	404	nM	10937734
CHEMBL311349	CCN1c2ncccc2C(=O)Nc3cc(C)c(C)nc13	410	nM	1712395
CHEMBL146828	O=C1Nc2c(COc3ccc(cc3)C#N)ccnc2N(C4CC4)c5ncccc15	410	nM	7490733
CHEMBL339406	CC(C)Nc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccc(OCCOCCOCCO)cc4[nH]3	410	nM	8809165
CHEMBL348086	CCC(C)Sc1nc(O)c(C)c(Cc2ccccc2F)n1	410	nM	10052969
CHEMBL336318	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4CC(C)C	410	nM	10514284
CHEMBL57216	Nc1ccc(CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F)cc1	412	nM	11459666
CHEMBL70930	CN1C(=O)c2cccnc2N(C(=O)C)c3cc(C)c(C)cc13	420	nM	1712395
CHEMBL344288	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)C#C	420	nM	7490732
CHEMBL143250	CCN1c2nc(O)cc(CO)c2NC(=O)c3cccnc13	420	nM	7490733
CHEMBL434122	O=C1Nc2c(COCCc3ccccc3)ccnc2N(C4CC4)c5ncccc15	420	nM	7490733
CHEMBL283614	CC(C)C#CC1(OCC(=O)Nc2ccc(Cl)cc12)C(F)(F)F	423	nM	11378361
CHEMBL124453	CCSc1cc(NCc2oc3ccccc3n2)c(O)nc1C	430	nM	1279173
CHEMBL424046	O=C1Nc2cccnc2N(C3CCC3)c4ncccc14	430	nM	1712395
CHEMBL32290	FC(F)(F)C1(OCC(=O)Nc2ccc(Cl)cc12)C#CC3CC3	432	nM	11378361
CHEMBL59215	FC(F)(F)[C@@]1(C#CC2CC2)[C@@H](OCc3cccnc3)C(=O)Nc4ccc(Cl)cc14	438	nM	11459666
CHEMBL123778	CCc1cc(NCc2oc3cccc(O)c3n2)c(O)nc1C	440	nM	1279173
CHEMBL328848	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4nccs4)cnc13	440	nM	9685235
CHEMBL291024	CCN1c2ncccc2NC(=O)c3cccnc13	440	nM	11170624
CHEMBL58970	FC(F)(F)[C@@]1(C#CC2CC2)[C@@H](OCc3ccccc3)C(=O)Nc4ccc(Cl)cc14	440	nM	11459666
CHEMBL177898	CCc1cc(CCc2oc3cc(F)ccc3n2)c(O)nc1C	442	nM	7683054
CHEMBL94526	Fc1cc2NC(=O)OC(C#CC3CC3)(c2c(F)c1F)C(F)(F)F	442	nM	10522695
CHEMBL290957	CCCN1c2ncccc2N(C)C(=O)c3cccnc13	450	nM	1712395
CHEMBL79696	Clc1ccc2NC(=O)NC(C#Cc3ccncc3)(C4CC4)c2c1	450	nM	7520079
CHEMBL144136	CC(C\N=C(/S)\Nc1nccs1)c2ccccc2	450	nM	8523406
CHEMBL126107	CCCNc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	450	nM	8809165
CHEMBL122460	CCNc1cccnc1N(CC)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C(C)C)ccc4[nH]3	450	nM	8809165
CHEMBL289816	O=C1Nc2cccnc2N(C3CC3)c4ncccc14	450	nM	11170624
CHEMBL160	CC[C@@H]1NC(=O)[C@H]([C@H](O)[C@H](C)C\C=C\C)N(C)C(=O)[C@H](C(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)N(C)C(=O)[C@@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CN(C)C1=O)C(C)C	455	nM	14643337
CHEMBL318730	CCc1cc(NCc2ccc3ccccc3c2)c(O)nc1C	457.09	nM	8831772
CHEMBL145158	Oc1ccccc1OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23	460	nM	7490733
CHEMBL301443	C=CCN1C(=O)c2ccccc2Oc3ccccc13	465	nM	1375293
CHEMBL125397	CCc1cc(NCc2oc3ccc(F)cc3n2)c(O)nc1C	470	nM	1279173
CHEMBL146169	CCN1c2ncccc2C(=O)N(C)c3ccc(O)nc13	470	nM	7490732
CHEMBL144701	COC(=O)CCCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	470	nM	10579849
CHEMBL323413	CNc1ccc2NC(=O)OC(C#CC(C)C)(c2c1)C(F)(F)F	473	nM	15546736
CHEMBL316083	FC(F)(F)C1(OC(=O)Nc2ccccc12)C#CC3CC3	478	nM	10522695
CHEMBL308644	C[C@@H]1Cn2c(S)nc3cc(Cl)cc([C@H](C)N1CC=C(C)C)c23	480	nM	8667357
CHEMBL36930	Fc1cccc(F)c1CCNC(=O)Nc2ccc(Cl)cn2	480	nM	9873380
CHEMBL145893	CCN1c2nc(cc(COc3ccccc3)c2NC(=O)c4cccnc14)c5cccc(OC)c5	490	nM	7490733
CHEMBL131761	COC(=O)c1cc(cc(Br)c1OC)C(=CCCN2CCOC2=O)c3cc(Br)c(OC)c(c3)C(=O)OC	499	nM	16162014
CHEMBL121835	CCc1cc(NCc2cc3ccccc3s2)c(O)nc1C	500	nM	1279173
CHEMBL305010	CCN1c2ccccc2C(=O)N(C)c3cccnc13	500	nM	1712395
CHEMBL37056	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(NS(=O)(=O)C)cc4[nH]3	500	nM	7684450
CHEMBL91891	CCC1(Oc2ccccc2n3cccc3C1=O)c4ccc5ccccc5c4	500	nM	8709096
CHEMBL53554	Fc1cccc(F)c1C2SCc3nc4ccccc4n23	500	nM	9435891
CHEMBL2092835	NC1=NC(=O)N(C=C1)[C@@H]2C[C@@H](F)[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2	500	nM	9622545
CHEMBL156083	CCCCSc1nc(O)cc(Cc2c(Cl)cccc2Cl)n1	500	nM	10052969
CHEMBL330537	Clc1ccc(NC(=S)NCCC2=CCCCC2)nc1	500	nM	10509923
CHEMBL124338	CC(C)Nc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	500	nM	10514284
CHEMBL611242	CCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	500	nM	10882373
CHEMBL288629	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3cccc(F)c3	500	nM	11931611
CHEMBL416617	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3cccc(Cl)c3	500	nM	11931611
CHEMBL199090	CC(C)CC(=O)c1c(O)c(CC(=C(C)C)O)c2OC(=O)C=C(c3ccccc3)c2c1O	500	nM	16137881
CHEMBL380643	COC(=O)C1=C([C@H]2c3ccccc3S[C@@]12C(=O)OC)N4CCC[C@H]4C	500	nM	16527484
CHEMBL213419	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(\C=C\CO)C1=O	500	nM	16884295
CHEMBL3414871	NS(=O)(=O)c1ccc(cc1)c2ccc(Cc3ccc4C(=O)N(O)C(=O)Cc4c3)cc2	500	nM	25522204
CHEMBL3414859	ON1C(=O)Cc2cc(Cc3ccc(F)cc3)ccc2C1=O	500	nM	25522204
CHEMBL3414876	Cc1ccc(cc1)S(=O)(=O)[O-].ON2C(=O)Cc3cc(Cc4ccc(cc4)c5cc[nH+]cc5)ccc3C2=O	500	nM	25522204
CHEMBL54318	Cc1cc(C)cc(c1)[S+]([O-])c2cccc(N)c2C#N	501.19	nM	15916427
CHEMBL297103	COC(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	504	nM	10937734
CHEMBL82904	CCc1ccc(CNc2cc(CC)c(C)nc2O)c(OC)c1	510	nM	7678654
CHEMBL103716	CCN1c2nc(ccc2N(C)C(=O)c3cc(CCc4ccccc4)cnc13)C5=CCC=N5	520	nM	9685235
CHEMBL267747	CCc1c(C)nn(c2ccccc2)c1c3ccccc3	520	nM	10715167
CHEMBL55862	Cc1cc(Cl)cc(c1)[S+]([O-])c2cccc(N)c2C#N	520	nM	11384233
CHEMBL123639	CCc1cc(NCc2ccc3ccccc3n2)c(O)nc1C	524.81	nM	8831772
CHEMBL313695	CCc1cc(NCc2ccccc2[N+](=O)[O-])c(O)nc1C	530	nM	7678654
CHEMBL100968	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4cncnc4)cnc13	540	nM	9685235
CHEMBL132770	CCCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4CC	540	nM	10514284
CHEMBL198050	COC(=O)CCC\C=C(/c1cccc(c1)C#N)\c2cc(C)c(OC)c(c2)C(=O)OC	540	nM	16913721
CHEMBL127427	Cc1cn(cn1)c2ccc3c(C)nc(CCCCCCC(=O)c4ccccc4)n3n2	550	nM	7504733
CHEMBL2115335	CCN1c2cc(Br)cnc2N(C)C(=O)c3cccnc13	550	nM	7537334
CHEMBL410771	FC(F)(F)c1csc(NC(=S)NCCc2ccccc2)n1	550	nM	8523406
CHEMBL106661	Cc1c(O)nc(SCC(=O)c2ccc(Cl)cc2)nc1Cc3cccc4ccccc34	550	nM	15149669
CHEMBL299710	CCN1C(=O)c2ccccc2Oc3ccccc13	560	nM	1375293
CHEMBL340248	Cc1nc(CCCCCCC(=O)c2ccccc2)n3ncccc13	560	nM	7504733
CHEMBL101834	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4ccc(NS(=O)(=O)C)cc4)cnc13	560	nM	9685235
CHEMBL144145	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccc(N)cc4	570	nM	7490732
CHEMBL332675	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)N4CCN(C)CC4)ccc3[nH]2)c5ncccc5NC(C)C	570	nM	8809165
CHEMBL103399	CCN1c2ncc(COc3ccccc3F)cc2C(=O)N(C)c4ccc(Cl)nc14	570	nM	9685236
CHEMBL312340	CCN1c2ccc(C)cc2C(=O)N(C)c3cccnc13	580	nM	1712395
CHEMBL356313	Cc1ccc(OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)cc1	580	nM	7490733
CHEMBL100629	CCN1c2ncccc2N(C)C(=O)c3cc(\C=C/c4ccccc4)cnc13	580	nM	9685235
CHEMBL71023	CC(C)N1c2ncccc2NC(=O)c3cccnc13	590	nM	1712395
CHEMBL314633	Clc1cc(Cl)cc(c1)C23SCCN2C(=O)c4ccccc34	590	nM	7689109
CHEMBL102735	CCN1c2ncc(CN(C)c3ccccc3)cc2C(=O)N(C)c4ccc(Cl)nc14	590	nM	9685236
CHEMBL32038	CC(C)C1OC(C#CC2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	597	nM	11378361
CHEMBL415716	CCc1c(C)nc(O)c(NCc2oc3ccccc3n2)c1C	600	nM	1279173
CHEMBL298405	CN1C(=O)c2ccccc2Oc3cc(C)ccc13	600	nM	1375293
CHEMBL357409	CCOC(=O)c1c(O)nc(C)c(CC)c1Sc2cc(C)cc(C)c2	600	nM	7473595
CHEMBL145397	CCN1c2nc(OC)ccc2N(C)C(=O)c3cccnc13	600	nM	7490732
CHEMBL254836	CCc1csc(NC(=S)NCCc2ccccc2)n1	600	nM	8523406
CHEMBL102957	Clc1ccccc1CCNC(=S)Nc2nccs2	600	nM	8523406
CHEMBL295978	CCN1c2ncccc2c3nccn3c4ccc(OC)nc14	600	nM	8648604
CHEMBL340145	Nc1cc(Cl)nc(SCC2=CCCc3ccccc23)n1	600	nM	9748354
CHEMBL156380	CC(C)CSc1nc(O)cc(Cc2c(Cl)cccc2Cl)n1	600	nM	10052969
CHEMBL346023	CCC(C)Sc1nc(O)cc(Cc2cccc(F)c2)n1	600	nM	10052969
CHEMBL69952	Brc1ccc(NC(=S)NCCN2CCCCC2)nc1	600	nM	10617082
CHEMBL295585	Fc1ccccc1CC\N=C(/S)\Nc2ccc(Br)cn2	600	nM	10999473
CHEMBL55199	COc1cccc(c1)S(=O)(=O)c2cccc(N)c2C#N	600	nM	11384233
CHEMBL151716	Oc1ccc(CCOC(=O)c2cc(O)c(O)c(O)c2)cc1O	600	nM	11844664
CHEMBL288535	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3ccccc3Cl	600	nM	11931611
CHEMBL191655	O=C1N(CCOC(=S)Nc2ccccc2)C(=O)c3ccccc13	600	nM	15916438
CHEMBL3414865	ON1C(=O)Cc2cc(Cc3ccc(cc3)c4ccccc4)ccc2C1=O	600	nM	25522204
CHEMBL46209	FC(F)(F)C1(C#CC2CC2)N(CC=C)c3ccccc3NC1=O	601	nM	10937734
CHEMBL322813	CNc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	608	nM	10576692
CHEMBL413751	CCc1cc(c(O)nc1C)C(OCc2c(F)cccc2F)(C#CC3CC3)C(F)(F)F	613	nM	11212098
CHEMBL55610	CN1C(=O)c2cc(O)ccc2Oc3cc(C)ccc13	640	nM	1375293
CHEMBL144852	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)N4CC=CC4	640	nM	7490732
CHEMBL144591	O=C1Nc2c(CC3=CCNC3)ccnc2N(C4CC4)c5ncccc15	640	nM	7490733
CHEMBL1203236	Cl.COc1ccc2c(C)nc(CCCCCCC(=O)c3ccccc3)n2n1	640	nM	7504733
CHEMBL435017	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4ccnn4	640	nM	7504733
CHEMBL69657	CCOCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2	640	nM	7540209
CHEMBL303466	CN1C(=O)c2cccnc2N(C#C)c3ccccc13	650	nM	1712395
CHEMBL302931	CCN1C(=O)c2cccc(C)c2N(CC)c3ncccc13	650	nM	1712395
CHEMBL359410	S=C(NCCc1occc1)Nc2nccs2	650	nM	8523406
CHEMBL8971	CCc1c(CCO)nn(c2ccccc2)c1c3ccccc3	650	nM	10715167
CHEMBL48629	FC(F)(F)C1(C#CC2CC2)N(CC=C)c3cc(Cl)ccc3NC1=O	650	nM	10937734
CHEMBL606999	[Na+].[Na+].[Na+].[Na+].CC1=CN([C@H]2C=C[C@]3(COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])C[C@H]23)C(=O)NC1=O	650	nM	12852759
CHEMBL126214	CCN(Cc1oc2c(Cl)ccc(Cl)c2n1)c3cc(CC)c(C)nc3O	654	nM	1279173
CHEMBL294848	CCCN1C(=O)c2cc(N)ccc2Oc3ccc(C)c(C)c13	670	nM	1375293
CHEMBL308222	CC1CN(CC(=C)C)Cc2cc(Cl)cc3NC(=S)N1c23	670	nM	8667357
CHEMBL321026	Cc1ccc(cc1)C(=O)CSc2nc(O)c(C)c(Cc3cccc4ccccc34)n2	670	nM	15149669
CHEMBL301986	CCCCOC(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	672	nM	10937734
CHEMBL85533	CCc1cc(NCc2cccnc2OC)c(O)nc1C	680	nM	7678654
CHEMBL133010	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCC(=O)N(C)C)c2cc(Cl)c(OC)c(c2)C(=O)OC	687	nM	11708913
CHEMBL70562	CCN1C(=O)c2ccccc2N(CC)c3ncccc13	690	nM	1712395
CHEMBL356278	O=C1Nc2c(CN3CCCC3)ccnc2N(C4CC4)c5ncccc15	700	nM	7490733
CHEMBL430623	O=C1N2CCSC2(c3ccccc3)c4ccccc14	700	nM	7689109
CHEMBL103235	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4cccc(c4)C(=O)OC)cnc13	700	nM	9685236
CHEMBL40625	Fc1cccc(CC\N=C(/S)\Nc2ccc(Br)cn2)c1	700	nM	10386942
CHEMBL40631	Clc1ccccc1CCNC(=S)Nc2ccc(Br)cn2	700	nM	10386942
CHEMBL114559	Brc1ccc(NC(=S)NCCc2ccc3OCOc3c2)nc1	700	nM	10617082
CHEMBL23361	Nc1nc(O)c2ncn(C3CC(OCP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(O)nc(N)nc56)C=C3)c2n1	700	nM	11881997
CHEMBL215724	COC(=O)CCC\C=C(\c1ccc(cc1)C#N)/c2cc(C)c3onc(OC)c3c2	700	nM	16913721
CHEMBL3414875	COc1ccc(cc1F)c2ccc(Cc3ccc4C(=O)N(O)C(=O)Cc4c3)cc2	700	nM	25522204
CHEMBL342068	CCN1c2nc(NC)ccc2N(C)C(=O)c3cccnc13	710	nM	7490732
CHEMBL134227	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@@H](OC(=O)C)[C@@H]1C)c5ccccc5	720	nM	7506311
CHEMBL314270	Cc1ccc2C(=O)N3CCSC3(c4ccccc4)c2c1	720	nM	7689109
CHEMBL297453	Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4cc(O)c(O)c(O)c4	730	nM	11591519
CHEMBL358555	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4cnc[nH]4	740	nM	7490732
CHEMBL121881	CC(C)Nc1ccnnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	740	nM	8809165
CHEMBL198425	COC(=O)CCC\C=C(/c1cccc(c1)C#N)\c2cc(Cl)c(OC)c(c2)C(=O)OC	750	nM	16162014
CHEMBL39950	CCN1c2ncc(C)cc2N(C)C(=O)c3cccnc13	760	nM	7537334
CHEMBL2115334	CN1C(=O)c2cccnc2N(C3CC3)c4cc(Cl)cnc14	760	nM	7537334
CHEMBL37789	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(CO)cc4[nH]3	760	nM	7684450
CHEMBL36327	Oc1cc(O)c2C[C@@H](OC(=O)c3cc(O)c(O)c(O)c3)[C@H](Oc2c1)c4ccc(O)c(O)c4	760	nM	11591519
CHEMBL313175	Cc1ccc(cc1)C23SCCN2C(=O)c4ccccc34	770	nM	7689109
CHEMBL106646	CCc1cc(c(O)nc1C)C(OC)(C#CC2CC2)C(F)(F)F	770	nM	11212098
CHEMBL99845	CCN1c2ncc(COc3cccc(O)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	780	nM	9685236
CHEMBL85425	CCc1cc(NCc2ccccc2C#N)c(O)nc1C	790	nM	7678654
CHEMBL94779	Fc1ccc(F)c2c1NC(=O)OC2(C#CC3CC3)C(F)(F)F	796	nM	10522695
CHEMBL283630	CCCC1OC(C#CC2CC2)(c3cc(Cl)ccc3NC1=O)C(F)(F)F	799	nM	11378361
CHEMBL145279	CCN1c2nc(OC)cc(C3OCCCO3)c2NC(=O)c4cccnc14	800	nM	7490733
CHEMBL125019	CC(C)Nc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccccc4[nH]3.CS(=O)(=O)O	800	nM	8809165
CHEMBL305612	Nc1ncnc2c1ncn2\C=C/3\CC3CO	800	nM	9438017
CHEMBL100394	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(COc4ccc(cc4)C(=O)OC)cnc13	800	nM	9685236
CHEMBL157777	CSc1nc(O)cc(Cc2c(F)cccc2F)n1	800	nM	10052969
CHEMBL35033	CCOCN1C(=O)NC(=O)C(=C1Cc2ccccc2)C(C)C	800	nM	10509923
CHEMBL317765	Fc1cc(F)c2NC(=O)OC(C#CC3CC3)(c2c1F)C(F)(F)F	800	nM	10522695
CHEMBL116474	Brc1ccc(NC(=S)NCCc2cccs2)nc1	800	nM	10617082
CHEMBL608301	CCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	800	nM	10882373
CHEMBL607724	CCCCCCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	800	nM	10882373
CHEMBL314572	CCC(c1cc(O)nc(SC(C)C)n1)c2cccc3ccccc23	800	nM	11472208
CHEMBL207123	COC(=O)C1=C([C@H]2c3ccccc3S[C@@]12C(=O)OC)N4CCCC4	800	nM	16527484
CHEMBL214391	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCc4ccccc4)C1=O	800	nM	16884295
CHEMBL3414864	ON1C(=O)Cc2cc(Cc3ccc(cc3)C4CC4)ccc2C1=O	800	nM	25522204
CHEMBL111413	Nc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	802	nM	10576692
CHEMBL94550	CN(C)c1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	816	nM	10522695
CHEMBL342056	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4occn4	820	nM	7490732
CHEMBL2368776	CCCN1C=Nc2c(ncn2[C@@H]3O[C@H](COC)[C@@H](OP(=O)(C)O)[C@H]3OC)C1=S	820	nM	12723951
CHEMBL351375	O=C1N2CCS[C@@H](c3ccccc23)c4ccccc14	830	nM	7681480
CHEMBL124248	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(Cl)ccc13	840	nM	7504733
CHEMBL134106	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4COC	840	nM	10514284
CHEMBL310490	CN1C(=O)c2cccnc2N(CC=C)c3ncccc13	850	nM	1712395
CHEMBL70743	CCN1c2nc(N)c(Cl)cc2N(C)C(=O)c3cccnc13	850	nM	1712395
CHEMBL142478	COc1ccc(O)c(Cc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)c1	850	nM	7490733
CHEMBL290410	CSCN1c2ncccc2N(C)C(=O)c3cccnc13	850	nM	11170624
CHEMBL313212	[O-][N+](=O)c1cccc(c1)C23SCCN2C(=O)c4ccccc34	860	nM	7689109
CHEMBL339279	CCCN(C1CCN(CC1)C(=O)c2cc3cc(NC(=O)N4CCN(C)CC4)ccc3[nH]2)c5ncccc5NC(C)C	860	nM	8809165
CHEMBL127456	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4nc(F)ccc4NC(C)C	880	nM	8809165
CHEMBL331726	CCc1nc(O)c(NCN2C(=O)c3ccccc3C2=O)cc1C	887	nM	1279172
CHEMBL305416	CCN1c2cc(ccc2N(C)C(=O)c3cc(Br)cnc13)[N+](=O)[O-]	890	nM	1712395
CHEMBL55387	COc1cc(cc(c1)C(F)(F)F)[S+]([O-])c2cccc(N)c2C#N	891.25	nM	15916427
CHEMBL111001	CC(C)C#CC1(OC(=O)Nc2ccc(N)cc12)C(F)(F)F	896	nM	15546736
CHEMBL57178	Fc1ccc(CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F)cc1	899	nM	11459666
CHEMBL54977	CCCN1C(=O)c2cc(N)ccc2Oc3c(C)cc(C)cc13	900	nM	1375293
CHEMBL83362	O=C1N2CCSC2(c3ccccc13)c4c5ccccc5cc6ccccc46	900	nM	7689109
CHEMBL314884	O=C1N2CCSC2(c3cccc4CCCc34)c5ccccc15	900	nM	7689109
CHEMBL149275	Nc1ccc(Cl)cc1S(=O)(=O)n2cccc2C(=O)OCC=C	900	nM	8558522
CHEMBL33981	S=C(NCCc1ccccc1)Nc2nccs2	900	nM	9873380
CHEMBL345908	CCC(C)Sc1nc(O)c(C)c(Cc2cccc(Cl)c2)n1	900	nM	10052969
CHEMBL170810	COc1ccc(CC\N=C(/S)\Nc2ccc(Br)cn2)cc1	900	nM	10636251
CHEMBL146770	S=C(NCCC1=CCCCC1)Nc2nccs2	900	nM	11229762
CHEMBL372175	COC(=O)CCC\C=C(/c1cc(F)cc(c1)C(F)(F)F)\c2cc(C)c3onc(OC)c3c2	900	nM	16162014
CHEMBL3414868	ON1C(=O)Cc2cc(Cc3ccc(cc3)c4ccc(cc4)C#N)ccc2C1=O	900	nM	25522204
CHEMBL357664	CCN1c2ncccc2C(=O)Nc3c(COCc4ccccc4)cc(OC)nc13	920	nM	7490733
CHEMBL125213	COC(=O)\C=C\CSc1nc(N)cc(Cl)n1	930	nM	9748354
CHEMBL1161005	CC1=CN([C@H]2CC(N=[N+]=[N-])C(COP(=S)(S)OP(=O)(O)OP(=O)(O)O)O2)C(=O)NC1=O	940	nM	7525960
CHEMBL296376	Cc1cccc(Sc2cccc(N)c2C#N)c1	954.99	nM	15916427
CHEMBL281239	CCC#CC1(OCC(=O)Nc2ccc(Cl)cc12)C(F)(F)F	964	nM	11378361
CHEMBL338872	CCc1cc(NC(C)c2oc3ccccc3c2)c(O)nc1C	970	nM	1279173
CHEMBL262374	Cc1ccc(C)c(c1)C23SCCN2C(=O)c4ccccc34	970	nM	7689109
CHEMBL316151	COc1cccc(c1)C23SCCN2C(=O)c4ccccc34	970	nM	7689109
CHEMBL433487	CN1C(=O)c2cccnc2Oc3cc(C)cc(N)c13	1000	nM	1375293
CHEMBL307280	CCN1c2ncccc2C(=O)N(C)c3cc(Cl)c(nc13)[N+](=O)[O-]	1000	nM	1712395
CHEMBL73753	CN1C(=O)c2cccnc2N(C)c3ccccc13	1000	nM	1712395
CHEMBL305754	CN1C(=O)c2ccccc2N(C)c3ccccc13	1000	nM	1712395
CHEMBL70511	CCN1c2nccc(OC)c2NC(=O)c3cccnc13	1000	nM	1712395
CHEMBL2114091	CC[C@H](C)N1c2ncccc2NC(=O)c3cccnc13	1000	nM	1712395
CHEMBL73468	CCN1c2ncccc2NC(=O)c3cc(C)cnc13	1000	nM	1712395
CHEMBL306167	CN(C)C(=O)CN1C(=O)c2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL302498	Cc1cc(C)c2NC(=O)c3ccccc3Nc2n1	1000	nM	1712395
CHEMBL70258	CN1C(=O)c2cccnc2N(C3CCCCC3)c4ncccc14	1000	nM	1712395
CHEMBL308491	CN1C(=O)c2cccnc2N(CCO)c3ccccc13	1000	nM	1712395
CHEMBL308229	CCN1c2cc(NC(=O)C)ccc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL305041	CCN1c2ncccc2N(C)C(=O)c3ccc(C)nc13	1000	nM	1712395
CHEMBL305243	CCN1c2ccc(O)cc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL70720	CN1C(=O)c2ccccc2N(C)c3ncccc13	1000	nM	1712395
CHEMBL71631	CCN1c2ncc(cc2N(C)C(=O)c3cccnc13)[N+](=O)[O-]	1000	nM	1712395
CHEMBL310699	CN1C(=O)c2cccnc2N(c3ncccc13)S(=O)(=O)C	1000	nM	1712395
CHEMBL73477	O=C1Nc2cccnc2N(c3ccccc3)c4ncccc14	1000	nM	1712395
CHEMBL2115140	CC[C@@H](C)N1c2ncccc2NC(=O)c3cccnc13	1000	nM	1712395
CHEMBL311908	CN1C(=O)c2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL70538	CC(=O)N1c2ccccc2N(CC=C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL70881	COCCN1C(=O)c2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL73015	CCCCN1c2ccccc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL306794	CCN(CC)C(=O)c1ccc2N(CC)c3ncccc3C(=O)N(C)c2c1	1000	nM	1712395
CHEMBL307162	CC(C)(C)OC(=O)CN1C(=O)c2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL72135	O=C1Nc2ccccc2Nc3ncccc13	1000	nM	1712395
CHEMBL312072	CCN1c2ccccc2N(CF)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL72150	CN1C(=O)c2cccnc2N(C(=O)C)c3ccccc13	1000	nM	1712395
CHEMBL70702	Cc1ccc2NC(=O)c3ccccc3Nc2n1	1000	nM	1712395
CHEMBL72392	CN1c2ccccc2NC(=O)c3cccnc13	1000	nM	1712395
CHEMBL71306	CN1C(=O)c2cccnc2N(CC#C)c3ncccc13	1000	nM	1712395
CHEMBL69666	CCN1c2ccc(cc2N(C)C(=O)c3cc(Br)cnc13)[N+](=O)[O-]	1000	nM	1712395
CHEMBL72225	Cc1ccnc2N(C3CC3)c4nccc(O)c4C(=O)Nc12	1000	nM	1712395
CHEMBL304158	CN1C(=O)c2c(C)cc(C)nc2N(C)c3ccc(C)cc13	1000	nM	1712395
CHEMBL306247	CCN1c2cc(cc(Br)c2N(C)C(=O)c3cccnc13)C(F)(F)F	1000	nM	1712395
CHEMBL307451	CN(C)CCN1c2cc(C)c(C)cc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL70047	CCN1c2ccc(CO)cc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL74240	CCN1c2ccccc2N(C)C(=O)c3ccccc13	1000	nM	1712395
CHEMBL72916	CCN1c2ncc(N)cc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL70753	CCC(=O)N1c2ccccc2N(CC=C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL70401	CCN1c2ncccc2NC(=O)c3c(C)ccnc13	1000	nM	1712395
CHEMBL70854	CCN1c2ccc(CNC(=O)C(C)(C)C)cc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL70532	CCN1c2cc(ccc2N(C)C(=O)c3cccnc13)C(=O)c4ccccc4	1000	nM	1712395
CHEMBL412157	CN1C(=O)c2cccnc2N(CC(=O)OC(C)(C)C)c3ccccc13	1000	nM	1712395
CHEMBL304563	Clc1ccc2Nc3ncccc3C(=O)N(CC=C)c2c1	1000	nM	1712395
CHEMBL304615	CCN1c2cccc(C)c2N(Cc3ccccc3)C(=O)c4cccnc14	1000	nM	1712395
CHEMBL72874	CCN1c2ccc(cc2N(C)C(=O)c3cccnc13)[N+](=O)[O-]	1000	nM	1712395
CHEMBL70572	Cc1cccc2Nc3ncccc3C(=O)Nc12	1000	nM	1712395
CHEMBL306895	CN1C(=O)c2cccnc2N(CC(=O)O)c3ccccc13	1000	nM	1712395
CHEMBL302034	CN(C)CCN1C(=O)c2cccnc2N(C3CC3)c4ncccc14	1000	nM	1712395
CHEMBL418886	OCCN1C(=O)c2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL306225	CCN1c2nccc(O)c2NC(=O)c3cccnc13	1000	nM	1712395
CHEMBL304965	CCN1c2ccccc2N(C)C(=O)c3cc(cnc13)C(F)(F)C(F)(F)F	1000	nM	1712395
CHEMBL71063	O=C1Nc2cccnc2N(C3CCCC3)c4ncccc14	1000	nM	1712395
CHEMBL419629	CN1C(=O)c2cccnc2N(CCF)c3ccccc13	1000	nM	1712395
CHEMBL72545	CCN1c2ccc(CN)cc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL311814	CCN1C(=O)c2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL303837	CCN1C(=O)c2cccnc2N(C)c3ccccc13	1000	nM	1712395
CHEMBL312019	CCN1c2ccc(cc2N(C)C(=O)c3cccnc13)C(=O)O	1000	nM	1712395
CHEMBL307792	O=C1Nc2cccnc2Nc3ccccc13	1000	nM	1712395
CHEMBL70754	CCOC(=O)N1c2ccccc2N(C)C(=O)c3cccnc13	1000	nM	1712395
CHEMBL343625	CCN1c2ncccc2C(=O)Nc3c(C)cc(NCCCO)nc13	1000	nM	7490732
CHEMBL344134	CCN1c2ncccc2C(=O)Nc3c(C)cc(nc13)C(C)(C)C	1000	nM	7490732
CHEMBL435030	CCN1c2nc(cc(C)c2NC(=O)c3cccnc13)N4CCSCC4	1000	nM	7490732
CHEMBL356314	CCN1c2ncccc2C(=O)N(C)c3ccc(N)nc13	1000	nM	7490732
CHEMBL142664	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccc(O)nc4	1000	nM	7490732
CHEMBL144949	CCN1c2nc(cc(C)c2NC(=O)c3cccnc13)C(C)C	1000	nM	7490732
CHEMBL342103	CCN1c2ncccc2C(=O)Nc3c(C)cc(C)nc13	1000	nM	7490732
CHEMBL345006	CCN1c2nc(N\C=C\C)ccc2N(C)C(=O)c3cccnc13	1000	nM	7490732
CHEMBL2115323	CN1C(=O)c2cccnc2N(C3CC3)c4ccc(Cl)nc14	1000	nM	7537334
CHEMBL37518	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(N)ccc4[nH]3	1000	nM	7684450
CHEMBL313273	Cc1ccnc(c1)C23SCCN2C(=O)c4ccccc34	1000	nM	7689109
CHEMBL253996	Fc1ccc(CCNC(=S)Nc2nccs2)cc1	1000	nM	8523406
CHEMBL102163	CCN1c2ncc(CCc3cccc(C)c3)cc2C(=O)N(C)c4ccc(Cl)nc14	1000	nM	9685235
CHEMBL100942	CCN1c2ncccc2N(C)C(=O)c3cc(C)cnc13	1000	nM	9685235
CHEMBL328408	CCN1c2ncccc2N(C)C(=O)c3cc(\C=C\C(=O)OC)cnc13	1000	nM	9685235
CHEMBL71766	CCN1c2ncccc2N(C)C(=O)c3cc(Cl)cnc13	1000	nM	9685235
CHEMBL319091	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccncc4)cnc13	1000	nM	9685235
CHEMBL100568	CCN1c2ncccc2N(C)C(=O)c3cc(cnc13)c4cccc(OC)c4	1000	nM	9685235
CHEMBL329938	CCN1c2ncc(CCc3ccccc3C)cc2C(=O)N(C)c4ccc(Cl)nc14	1000	nM	9685235
CHEMBL101998	CCN1c2ncc(CCc3ccncc3)cc2C(=O)N(C)c4ccc(nc14)C#N	1000	nM	9685235
CHEMBL327744	CCN1c2nc(Cl)ccc2N(C)C(=O)c3cc(CCc4ccnc(CO)c4)cnc13	1000	nM	9685235
CHEMBL330183	CCN1c2ncccc2N(C)C(=O)c3cc(cnc13)C(=O)O	1000	nM	9685235
CHEMBL111153	CCC(C)Sc1nc(O)cc(Cc2ccccc2)n1	1000	nM	10052969
CHEMBL131972	CCOc1ccc(Cl)c(C2CC2NC(=O)Nc3cc(Cl)cnn3)c1F	1000	nM	10514285
CHEMBL107200	COC(=O)CCCC=C(c1cc(Br)c(OC)c(c1)C(=O)OC)c2cc(Br)c(OC)c(c2)C(=O)OC	1000	nM	10579849
CHEMBL141323	CCC(=O)CCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	1000	nM	10579849
CHEMBL355333	COc1ccccc1CC\N=C(/S)\Nc2ccc(Br)cn2	1000	nM	10636251
CHEMBL611243	CCCCCCCCCCCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	1000	nM	10882373
CHEMBL289072	CCN1c2ncc(Cl)cc2N(C)C(=O)c3cccnc13	1000	nM	11170624
CHEMBL291267	CN1C(=O)c2cccnc2N(C3CC3)c4nccc(C)c14	1000	nM	11170624
CHEMBL335768	CCCCCC=C(c1cc(C)c(OC)c(c1)C(=O)OC)c2cc(C)c(OC)c(c2)C(=O)OC	1000	nM	11708913
CHEMBL428685	COC(=O)CCCC=C(c1cc(C)c(OC)c(c1)C(=O)OC)c2cc(C)c(OC)c(c2)C(=O)OC	1000	nM	11708913
CHEMBL175566	O\C(=C/C(=O)c1nc[nH]n1)\c2ccc(Cc3ccc(F)cc3)[nH]2	1000	nM	15634005
CHEMBL425146	O\C(=C/C(=O)c1cc[nH]c1)\c2oc(Cc3ccc(F)cc3)cc2	1000	nM	15634005
CHEMBL2373970	OC(=O)CN1C[C@]23[C@H]4[C@@H]5c6c7c8[C@H]9[C@@H]%10[C@@H]%11[C@H]%12C%13=C%14C%15=C%11c%16c%10c%17c8c%18c6c%19c5c%20c%21c%22c(c%23C%24=C2c%25c([C@@H]%13[C@H]%24c%26c%14c%27c%15c%28c%16c%29c%17c%18c%30c%19c%21c%31c%30c%29c%28c%32c%27c(c%23%26)c%22c%31%32)c%12c9c7c4%25)[C@]3%20[C@@H]1C(=O)O	1000	nM	15686922
CHEMBL297956	Nc1cccc(c1C#N)S(=O)(=O)c2cccc3ccccc23	1000	nM	15916427
CHEMBL39092	OC(=O)c1ccc2ccc(\C=C\c3ccc(O)c(O)c3)nc2c1O	1000	nM	16002283
CHEMBL198551	COC(=O)c1cc(cc(C)c1OC)\C(=C/CCN2CCOC2=O)\c3ccc(OC)c(OC)c3	1000	nM	16162014
CHEMBL1738875	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)NC1=O	1000	nM	16884295
CHEMBL3414861	ON1C(=O)Cc2cc(Cc3ccc(Br)cc3)ccc2C1=O	1000	nM	25522204
CHEMBL61152	Nc1ccccc1CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F	1019	nM	11459666
CHEMBL145730	O=C1Nc2c(CSc3ccccc3)ccnc2N(C4CC4)c5ncccc15	1030	nM	7490733
CHEMBL422839	O=C1Nc2c(CN3CCOCC3)ccnc2N(C4CC4)c5ncccc15	1030	nM	7490733
CHEMBL543611	Cl.Brc1ccc(NC(=S)NCCc2ccccn2)nc1	1030	nM	15916438
CHEMBL357877	COc1ccc(OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)cc1	1040	nM	7490733
CHEMBL124992	CCc1cc(N(C)Cc2oc3c(Cl)ccc(Cl)c3c2)c(O)nc1C	1050	nM	1279173
CHEMBL124556	CC(O)c1cc(NCc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	1050	nM	1279173
CHEMBL87799	FC(F)(F)c1cccc(c1)C23SCCN2C(=O)c4ccccc34	1050	nM	7689109
CHEMBL123478	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4nc(F)ccc4NC(C)(C)C	1050	nM	8809165
CHEMBL294406	CCCO[C@H]1C(=O)Nc2ccc(Cl)cc2[C@@]1(C#CC3CC3)C(F)(F)F	1051	nM	11459666
CHEMBL145273	CCN1c2nc(O)cc(COCc3ccccc3)c2NC(=O)c4cccnc14	1070	nM	7490733
CHEMBL121834	CCc1cc(NCC2=COc3ccccc3C2=O)c(O)nc1C	1100	nM	1279173
CHEMBL418885	CCN1c2ccc(cc2N(C)C(=O)c3cccnc13)C(=O)OC	1100	nM	1712395
CHEMBL143107	COc1ccc2N(C)C(=O)c3cccnc3N(C4CC4)c2n1	1100	nM	7490732
CHEMBL358564	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4cncs4	1100	nM	7490732
CHEMBL174267	Cc1nc(O)c(CCc2oc3ccccc3n2)cc1c4ccccc4	1100	nM	7683054
CHEMBL85697	CCc1cccc(c1)C23SCCN2C(=O)c4ccccc34	1100	nM	7689109
CHEMBL400684	Oc1ccccc1CCNC(=S)Nc2nccs2	1100	nM	8523406
CHEMBL147375	S=C(NCCc1cccc(Oc2ccccc2)c1)Nc3nccs3	1100	nM	8523406
CHEMBL135804	Cn1cccc1CC\N=C(/S)\Nc2ccc(cn2)C#N	1100	nM	8863804
CHEMBL149055	CC(C)Oc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	1100	nM	8978855
CHEMBL306257	Nc1nc(O)c2ncn(\C=C/3\CC3CO)c2n1	1100	nM	9438017
CHEMBL420460	CCN1c2ncccc2N(C)C(=O)c3cc(NC(=O)N)cnc13	1100	nM	9685235
CHEMBL351323	CC(C)CSc1nc(O)c(C)c(Cc2c(Cl)cccc2Cl)n1	1100	nM	10052969
CHEMBL336635	CCc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	1100	nM	10514284
CHEMBL294627	Cc1cc(C)cc(Sc2cccc(N)c2C#N)c1	1100	nM	11384233
CHEMBL293806	Nc1cccc(Sc2cccc(c2)C#N)c1C#N	1100	nM	11384233
CHEMBL3414858	Cc1ccc(Cc2ccc3C(=O)N(O)C(=O)Cc3c2)cc1	1100	nM	25522204
CHEMBL147800	Oc1ccccc1Cc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23	1120	nM	7490733
CHEMBL106204	CC(=O)CSc1nc(O)c(C)c(Cc2cccc3ccccc23)n1	1120	nM	15149669
CHEMBL124991	CCc1cc(NC(C)c2ccc3ccccc3c2)c(O)nc1C	1130	nM	1279173
CHEMBL141443	[O-][N+](=O)c1ccc(OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)cc1	1130	nM	7490733
CHEMBL187718	CCCC1=C(OC2CCCCC2)c3cc(Cl)ccc3NC1=O	1130	nM	15537346
CHEMBL2115319	CC[C@H]1O[C@@](C#CC2CC2)(c3cc(F)ccc3NC1=O)C(F)(F)F	1140	nM	11378361
CHEMBL439929	CC(C)COC(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	1142	nM	10937734
CHEMBL125666	Cc1nc(O)c(NCc2oc3ccccc3n2)cc1S(=O)(=O)C	1150	nM	1279173
CHEMBL303241	C[C@@H]1CN2C(=S)Nc3cccc([C@H](C)N1CC=C(C)C)c23	1150	nM	8667357
CHEMBL345580	CC(C)Sc1nc(O)c(C)c(Cc2c(Cl)cccc2Cl)n1	1150	nM	10052969
CHEMBL156636	CCCCSc1nc(O)c(C)c(Cc2c(Cl)cccc2Cl)n1	1150	nM	10052969
CHEMBL330597	CCN1c2ncccc2N(C)C(=O)c3cc(CCCc4ccccc4)cnc13	1170	nM	9685235
CHEMBL15411	Cc1cc(C)c2NC(=O)c3cccnc3N(C4CC4)c2n1	1200	nM	7490732
CHEMBL145287	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4ccc(OC)nc4	1200	nM	7490732
CHEMBL112886	CCC(C)Sc1nc(O)cc(Cc2cccc(C)c2)n1	1200	nM	7650679
CHEMBL37080	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(O)cc4[nH]3	1200	nM	7684450
CHEMBL289969	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	1200	nM	7684450
CHEMBL145897	S=C(NCc1ccccc1)Nc2nccs2	1200	nM	8523406
CHEMBL318720	CCN1c2ncccc2N(C)C(=O)c3cc(Cc4ccccc4)cnc13	1200	nM	9685235
CHEMBL322898	CCC(C)Sc1nc(O)cc(Cc2ccc(cc2)[N+](=O)[O-])n1	1200	nM	10052969
CHEMBL114598	Brc1ccc(NC(=S)NCCc2occc2)nc1	1200	nM	10617082
CHEMBL292339	C[C@@H](\N=C(/S)\Nc1ccc(Cl)cn1)c2ccccc2	1200	nM	10999473
CHEMBL294743	C[C@@H](\N=C(/S)\Nc1ccc(Br)cn1)C2CCCCC2	1200	nM	10999473
CHEMBL2373486	OC(=O)C1(C(=O)O)[C@]23[C@H]4[C@@H]5c6c7c8[C@H]9[C@H]%10c%11c%12c8c%13c6c%14c5c%15c%16c%17c%18c%19c%20c%21c%22c%18c(c%14%17)c%13c%12c%22c%23c%11c%24c%25C%26=C%27[C@H]%28[C@@H]%29C(=C2c%30c4c7c9c(c%28%30)[C@@]%27%31[C@@]%10%24C%31(C(=O)O)C(=O)O)c%32c(c%16c%19c%33c%32c%29c%26c(c%25c%21%23)c%20%33)[C@]13%15	1200	nM	15686922
CHEMBL215542	COC(=O)CCC\C=C(\c1ccc(cc1)C#N)/c2cc(C)c3OC(=O)N(C)c3c2	1200	nM	16913721
CHEMBL16755	ON1C(=O)Cc2ccccc2C1=O	1200	nM	25522204
CHEMBL96328	FC(F)(F)Oc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	1249	nM	10522695
CHEMBL338658	CCc1cc(NCc2oc3ccc(C)cc3n2)c(O)nc1C	1250	nM	1279173
CHEMBL124186	CCc1cc(NCc2oc3cc(F)ccc3n2)c(O)nc1C	1250	nM	1279173
CHEMBL85945	CCc1cc(NCc2cccc(OC)c2)c(O)nc1C	1250	nM	7678654
CHEMBL175089	CCc1cc(CNc2oc3ccccc3n2)c(O)nc1C	1250	nM	7683054
CHEMBL291113	O=C1Nc2c(ccnc2N(C3CC3)c4ncccc14)C#N	1250	nM	11170624
CHEMBL208008	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3)S(=O)(=O)N	1252	nM	16503141
CHEMBL443996	Fc1ccccc1CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F	1296	nM	11459666
CHEMBL144378	CCNc1ccc2N(C)C(=O)c3cccnc3N(CC)c2n1	1300	nM	7490732
CHEMBL433925	CCOCc1ccnc2N(C3CC3)c4ncccc4C(=O)Nc12	1300	nM	7490733
CHEMBL357250	CCN1c2nc(O)cc(Cc3ccccc3)c2NC(=O)c4cccnc14	1300	nM	7490733
CHEMBL338339	Cc1nc(CCCCCOC(=O)c2ccccc2)n3nc(Cl)ccc13	1300	nM	7504733
CHEMBL338415	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4nccn4	1300	nM	7504733
CHEMBL2115326	CCN1c2ncccc2N(C)C(=O)c3cc(Br)cnc13	1300	nM	7537334
CHEMBL298243	CCN1c2cccnc2N(C)C(=O)c3cccnc13	1300	nM	7537334
CHEMBL284241	Cc1cccc(Cc2nc(SC3CCCCC3)nc(O)c2C)c1	1300	nM	7650679
CHEMBL86178	CCc1cc(NCc2c(C)cccc2OC)c(O)nc1C	1300	nM	7678654
CHEMBL289304	COc1ccc2cc([nH]c2c1)C(=O)N3CCN(CC3)c4ncccc4NC(C)C	1300	nM	7684450
CHEMBL38068	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(O)ccc4[nH]3	1300	nM	7684450
CHEMBL357187	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCCN=[N+]=[N-])c2cc(Cl)c(OC)c(c2)C(=O)OC	1300	nM	10579849
CHEMBL317356	Brc1ccc(NC(=S)NCCc2ccccc2)nc1	1300	nM	10636251
CHEMBL149161	S=C(NCC12CC3CC(CC(C3)C1)C2)Nc4nccs4	1300	nM	11229762
CHEMBL269742	[I-].[I-].CCCCCCCCCC[N@@+]1(C)C[C@]23[C@H]4[C@@H]5C6=C7c8c4c9C2=C%10[C@H]%11[C@H]%12c9c%13c8[C@@H]%14[C@@H]%15c%16c%13c%12c%17c%18c%11c%19c%10c%20c%21c%22c(c5c%23c6c%24c%25c%26c(c%15c%27c%16c%17c%28c%18c%29c%30c%31c%28c%27c%26c%31c%32c(c%30c%21c%19%29)c%22c%23c%25%32)[C@]%24%33C[N+](C)(C)C[C@@]7%14%33)[C@@]3%20C1	1300	nM	15686922
CHEMBL3414857	ON1C(=O)Cc2cc(Cc3ccccc3)ccc2C1=O	1300	nM	25522204
CHEMBL103437	CCN1c2ncccc2N(C)C(=O)c3cc(COc4cc[n+]([O-])cc4)cnc13	1340	nM	9685236
CHEMBL105630	CCc1cc(c(O)nc1C)C(OCc2ccccc2)(C#CC3CC3)C(F)(F)F	1348	nM	11212098
CHEMBL313481	O=C1N2CCSC2(c3occc3)c4ccccc14	1350	nM	7689109
CHEMBL145049	O=C1Nc2c(CNc3ccccc3)ccnc2N(C4CC4)c5ncccc15	1370	nM	7490733
CHEMBL72535	C=CCN1C(=O)c2cccnc2Nc3ccccc13	1400	nM	1712395
CHEMBL359187	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccccc4	1400	nM	7490732
CHEMBL86261	CCc1cc(NCc2ccccc2F)c(O)nc1C	1400	nM	7678654
CHEMBL176814	CCc1cc([S+]([O-])Cc2oc3c(Cl)ccc(Cl)c3n2)c(O)nc1C	1400	nM	7683054
CHEMBL38129	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(C=O)cc4[nH]3	1400	nM	7684450
CHEMBL151955	CC(C)Oc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	1400	nM	8978855
CHEMBL41458	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3ccc(Cl)cc3Cl	1400	nM	10698447
CHEMBL55308	COc1ccccc1S(=O)(=O)c2cccc(N)c2C#N	1400	nM	11384233
CHEMBL314925	CCC(c1cc(O)nc(SC2CCCCC2)n1)c3cccc4ccccc34	1400	nM	11472208
CHEMBL2373427	[I-].[I-].C[N+]1(C)C[C@]23[C@H]4[C@@H]5c6c7c8[C@H]9[C@H]%10c%11c%12c8c%13c6c%14c5c%15c%16c%17c%18c%19c%20c%21c%22c%18c(c%14%17)c%13c%12c%22c%23c%11c%24c%25C%26=C%27[C@H]%28[C@@H]%29C(=C2c%30c4c7c9c(c%28%30)[C@]%27%31C[N+](C)(C)C[C@]%10%24%31)c%32c(c%16c%19c%33c%32c%29c%26c(c%25c%21%23)c%20%33)[C@]3%15C1	1400	nM	15686922
CHEMBL3414870	CS(=O)(=O)c1ccc(cc1)c2ccc(Cc3ccc4C(=O)N(O)C(=O)Cc4c3)cc2	1400	nM	25522204
CHEMBL358782	C=CCOCc1ccnc2N(C3CC3)c4ncccc4C(=O)Nc12	1410	nM	7490733
CHEMBL58408	FC(F)(F)[C@@]1(C#CC2CC2)[C@@H](OCC3CC3)C(=O)Nc4ccc(Cl)cc14	1434	nM	11459666
CHEMBL85829	CCc1cc(NCc2ccccc2Cl)c(O)nc1C	1450	nM	7678654
CHEMBL86215	[O-][S+]1CCN2C(=O)c3ccccc3C12c4ccccc4	1450	nM	7689109
CHEMBL125324	CCCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NC(C)(C)C	1450	nM	8809165
CHEMBL292468	Nc1cccc(CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F)c1	1455	nM	11459666
CHEMBL124578	Nc1cc(Cl)nc(SCc2ccccc2)n1	1470	nM	9748354
CHEMBL142853	CN1C(=O)c2cccnc2N(C3CC3)c4nc(ccc14)c5cn[nH]c5	1500	nM	7490732
CHEMBL309696	Clc1ccc2NC(=O)NC(C#Cc3cncnc3)(C4CC4)c2c1	1500	nM	7520079
CHEMBL87284	CCc1cc(NCc2ccccc2SC)c(O)nc1C	1500	nM	7678654
CHEMBL317866	CN(\C(=N\CCc1ccccc1)\S)c2nccs2	1500	nM	8523406
CHEMBL318343	CCN1c2ncc(CCc3ccnc(c3)C(=O)O)cc2C(=O)N(C)c4ccc(Cl)nc14	1500	nM	9685235
CHEMBL160781	CCC(C)Sc1nc(O)c(C)c(Cc2cccc(F)c2)n1	1500	nM	10052969
CHEMBL156208	CC(C)Sc1nc(O)cc(Cc2c(Cl)cccc2Cl)n1	1500	nM	10052969
CHEMBL41119	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3ccc(cc3)C(C)(C)C	1500	nM	10698447
CHEMBL151773	CCC(\N=C(/S)\Nc1nccs1)c2ccccc2	1500	nM	11229762
CHEMBL3414863	ON1C(=O)Cc2cc(Cc3ccc(F)cc3F)ccc2C1=O	1500	nM	25522204
CHEMBL3414873	ON1C(=O)Cc2cc(Cc3ccc(cc3)c4ccc(F)cc4F)ccc2C1=O	1500	nM	25522204
CHEMBL326224	CCCC#CC1(OC(=O)Nc2ccc(N)cc12)C(F)(F)F	1506	nM	10576692
CHEMBL51738	COc1cccc(Sc2cccc(N)c2C#N)c1	1513.56	nM	15916427
CHEMBL340403	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4nc(Cl)ccc4NC(C)(C)C	1520	nM	8809165
CHEMBL315689	CCc1cc(NCc2ncccc2OC)c(O)nc1C	1550	nM	7678654
CHEMBL291970	FC(F)(F)[C@@]1(C#CC2CC2)[C@@H](OCc3ccccn3)C(=O)Nc4ccc(Cl)cc14	1572	nM	11459666
CHEMBL342771	CCN1c2nc(ccc2N(C)C(=O)c3cccnc13)c4ccccn4	1600	nM	7490732
CHEMBL58607	Cc1cccc2c1nc(c3c(F)cccc3F)n2Cc4ccccc4	1600	nM	9435891
CHEMBL319762	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccccc4C)cnc13	1600	nM	9685235
CHEMBL157349	CCC(C)Sc1nc(O)cc(Cc2ccccc2Cl)n1	1600	nM	10052969
CHEMBL414976	[I-].[I-].C[N+]1(C)C[C@]23[C@H]4[C@@H]5c6c7c8[C@H]9[C@H]%10C%11=C%12c8c%13c6c%14c5c%15c%16c%17c%18c%19c%20c([C@@H]%21[C@H]%11[C@@]%22%23C[N+](C)(C)C[C@]%22%24C%25=C%26[C@H]%27[C@@H]%28C(=C2c%29c%27c(C%26=C%10%23)c9c7c4%29)c%30c(c%16c%31c%18c%32c%20c%21c%24c%33c%25c%28c%30c%31c%32%33)[C@]3%15C1)c%12c%13c%19c%14%17	1600	nM	15686922
CHEMBL378943	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(\C=C/CO)C1=O	1600	nM	16884295
CHEMBL387370	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCO)C1=O	1600	nM	16884295
CHEMBL191146	CCCC1=C(SC2CCCCC2)c3cc(Cl)ccc3NC1=O	1610	nM	15537346
CHEMBL297982	CCN1c2ncccc2c3nccn3c4c(C)ccnc14	1620	nM	8648604
CHEMBL125504	CCc1cc(NCc2oc3cc(C)ccc3n2)c(O)nc1C	1650	nM	1279173
CHEMBL313366	Cc1cccc(c1C)C23SCCN2C(=O)c4ccccc34	1650	nM	7689109
CHEMBL125392	Oc1ncccc1NCN2C(=O)c3ccccc3C2=O	1660	nM	1279172
CHEMBL67451	CCCN1Cc2cccc3NC(=S)N(CC1C)c23	1670	nM	8667357
CHEMBL358947	CCN1c2nc(CC)cc(C)c2NC(=O)c3cccnc13	1700	nM	7490732
CHEMBL175531	CCc1cc(CCc2oc3ccc(F)cc3n2)c(O)nc1C	1700	nM	7683054
CHEMBL103593	CCN1c2ncccc2N(C)C(=O)c3cc(CCc4ccccc4N)cnc13	1700	nM	9685235
CHEMBL88121	OC(=O)c1cc(Br)ccc1NC(=O)CCCCC(=O)Nc2ccc(Br)cc2C(=O)O	1700	nM	9873592
CHEMBL157685	Cc1c(O)nc(SC2CCCC2)nc1Cc3c(Cl)cccc3Cl	1700	nM	10052969
CHEMBL56324	Cc1cc(Cl)cc(Sc2cccc(N)c2C#N)c1	1700	nM	11384233
CHEMBL384970	[I-].[I-].C[N+]1(C)C[C@]23[C@H]4[C@@H]5C6=C7c8c4c9C2=C%10[C@H]%11[C@H]%12c9c%13c8[C@@H]%14[C@@H]%15c%16c%13c%12c%17c%18c%11c%19c%10c%20c%21c%22c(c5c%23c6c%24c%25c%26c(c%15c%27c%16c%17c%28c%18c%29c%30c%31c%28c%27c%26c%31c%32c(c%30c%21c%19%29)c%22c%23c%25%32)[C@]%24%33C[N+](C)(C)C[C@@]7%14%33)[C@@]3%20C1	1700	nM	15686922
CHEMBL195108	OC(=O)c1ccccc1C(=O)NCCO\C(=N/c2ccc(I)cc2)\S	1700	nM	15916438
CHEMBL379493	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC(=O)N)C1=O	1700	nM	16884295
CHEMBL123966	CCOC(=O)c1cc(NCc2oc3ccccc3n2)c(O)nc1C	1750	nM	1279173
CHEMBL2115322	CCN1c2ccc(C)nc2N(C)C(=O)c3cccnc13	1760	nM	7537334
CHEMBL59059	Fc1cccc(CO[C@H]2C(=O)Nc3ccc(Cl)cc3[C@@]2(C#CC4CC4)C(F)(F)F)c1	1776	nM	11459666
CHEMBL36835	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NC(=O)C)ccc4[nH]3	1800	nM	7684450
CHEMBL356163	CC(C)Oc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	1800	nM	8978855
CHEMBL323573	CCC(C)Sc1nc(O)c(C)c(Cc2ccc(cc2)[N+](=O)[O-])n1	1800	nM	10052969
CHEMBL299271	Nc1cccc(c1C#N)S(=O)(=O)c2cccc(c2)C#N	1800	nM	11384233
CHEMBL49030	FC(F)(F)C1(C#CC2CC2)N(CC#C)c3ccccc3NC1=O	1807	nM	10937734
CHEMBL84717	O=C1N2CCSC2(c3cccc(c3)C#N)c4ccccc14	1810	nM	7689109
CHEMBL301996	FC(F)(F)C1(C#CC2CC2)N(Cc3ccccc3)c4ccccc4NC1=O	1818	nM	10937734
CHEMBL125896	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)N4CCN(C)CC4)ccc3[nH]2)c5ncccc5NC(C)(C)C	1830	nM	8809165
CHEMBL106659	CCc1cc(c(O)nc1C)C(OCC#N)(C#CC2CC2)C(F)(F)F	1842	nM	11212098
CHEMBL177192	CN(C)c1cc(CCc2oc3ccccc3n2)c(O)nc1C	1850	nM	7683054
CHEMBL135509	Brc1ccc(NC(=S)NCCC2=NC3C=CC=CC3N2)nc1	1860	nM	8863804
CHEMBL321484	CCC#CC1(OC(=O)Nc2ccc(N)cc12)C(F)(F)F	1894	nM	10576692
CHEMBL124838	CCc1cc(NCc2oc3cccnc3n2)c(O)nc1C	1900	nM	1279173
CHEMBL144130	Cn1cccc1CC\N=C(/S)\Nc2nccs2	1900	nM	8523406
CHEMBL144420	S=C(NCCc1ccccc1)Nc2nncs2	1900	nM	8523406
CHEMBL330990	CN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4nc(F)ccc4NC(C)(C)C	1900	nM	8809165
CHEMBL252963	CN(C)c1ccc(F)c(CCNC(=S)Nc2ccc(Cl)cn2)c1F	1900	nM	8863804
CHEMBL443063	CN(C)c1ccc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1F	1900	nM	8863804
CHEMBL151173	CCOc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	1900	nM	8978855
CHEMBL75956	Nc1nc(O)c2ncn(\C=C\3/CC3CO)c2n1	1900	nM	9438017
CHEMBL422001	CCC(C)Sc1nc(O)cc(Cc2cccc(Cl)c2)n1	1900	nM	10052969
CHEMBL289429	CCN1c2ncccc2C(=O)N(C)c3c(C)ccnc13	1900	nM	11170624
CHEMBL96591	FC(F)(F)C1(OC(=O)Nc2cc3ccccc3cc12)C#CC4CC4	1909	nM	10522695
CHEMBL335037	CCOC(=O)NCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	1930	nM	11708913
CHEMBL2115318	C[C@H]1O[C@@](C#CC2CC2)(c3cc(F)ccc3NC1=O)C(F)(F)F	1940	nM	11378361
CHEMBL125120	CCc1cc(NCc2oc3ccccc3c2C)c(O)nc1C	1950	nM	1279173
CHEMBL321786	CCc1cc(c(O)nc1C)C(OCc2c(F)cccc2OC)(C#CC3CC3)C(F)(F)F	1951	nM	11212098
CHEMBL94541	CC(C)c1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	1958	nM	10522695
CHEMBL190170	CC(C)C1=C(OC2CCCCC2)c3cc(Cl)ccc3NC1=O	1960	nM	15537346
CHEMBL155936	OC1(CC1)C#CC2(OC(=O)Nc3ccc(Cl)cc23)C(F)(F)F	1983	nM	11266155
CHEMBL123514	CCc1nc(CCCCCCC(=O)c2ccccc2)n3nc(Cl)ccc13	2000	nM	7504733
CHEMBL36656	CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(O)ccc4[nH]3	2000	nM	7684450
CHEMBL400708	CC(=O)NCc1ccc(F)c(CCNC(=S)Nc2ccc(Br)cn2)c1F	2000	nM	8863804
CHEMBL317574	CNC(=O)c1ccc(F)c(CC\N=C(/S)\Nc2ccc(Br)cn2)c1F	2000	nM	8863804
CHEMBL358754	CC(C)Oc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	2000	nM	8978855
CHEMBL151565	CC(C)Nc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	2000	nM	8978855
CHEMBL94884	FC(F)(F)C1(OC(=O)Nc2ccc(cc12)c3ccccc3)C#CC4CC4	2000	nM	10522695
CHEMBL94269	Fc1cc2c(NC(=O)OC2(C#CC3CC3)C(F)(F)F)c(F)c1F	2000	nM	10522695
CHEMBL316479	FC(F)(F)C1(OC(=O)Nc2c(Cl)cc(Cl)cc12)C#CC3CC3	2000	nM	10522695
CHEMBL148698	S=C(NCc1occc1)Nc2nccs2	2000	nM	11229762
CHEMBL407128	CC(=O)N[C@H]1C(=O)Nc2ccc(Cl)cc2[C@@]1(C#CC3CC3)C(F)(F)F	2000	nM	11459666
CHEMBL57650	O[C@H]1C(=O)Nc2ccc(Cl)cc2[C@@]1(C#CC3CC3)C(F)(F)F	2000	nM	11459666
CHEMBL293069	FC(F)(F)[C@@]1(C#CC2CC2)[C@@H](NCc3ccccc3)C(=O)Nc4ccc(Cl)cc14	2000	nM	11459666
CHEMBL58348	CC(=CCO[C@H]1C(=O)Nc2ccc(Cl)cc2[C@@]1(C#CC3CC3)C(F)(F)F)C	2000	nM	11459666
CHEMBL293536	COC(=O)N[C@H]1C(=O)Nc2ccc(Cl)cc2[C@@]1(C#CC3CC3)C(F)(F)F	2000	nM	11459666
CHEMBL23358	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)OP(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(N)ncnc56)C=C3	2000	nM	11881997
CHEMBL166126	Clc1ccc(cc1)N(C(=S)OCCN2C(=O)c3ccccc3C2=O)C(=O)c4ccnc(Cl)c4	2000	nM	12593657
CHEMBL111598	CC(C)C#CC1(OC(=O)Nc2ccc(NC(=O)C)cc12)C(F)(F)F	2000	nM	15546736
CHEMBL111492	CC(=O)Nc1ccc2NC(=O)OC(C#CC3CC3)(c2c1)C(F)(F)F	2000	nM	15546736
CHEMBL379813	COc1ccc(cc1OC2CCCC2)[C@@H]3CN(C(=O)C3)c4cccc(N)c4	2000	nM	16632349
CHEMBL212394	COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)\c2cc(C)c3ON(C)C(=O)c3c2	2000	nM	16913721
CHEMBL3414862	ON1C(=O)Cc2cc(Cc3ccc(cc3)C(F)(F)F)ccc2C1=O	2000	nM	25522204
CHEMBL754	[Na+].[Na+].[Na+].[O-]C(=O)P(=O)([O-])[O-]	2030	nM	9240351
CHEMBL331684	CCN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)N4CCN(C)CC4)ccc3[nH]2)c5nc(F)ccc5NC(C)(C)C	2070	nM	8809165
CHEMBL125873	CCc1cc(NCc2cccc3ccccc23)c(O)nc1C	2089.3	nM	8831772
CHEMBL71310	CCN1c2ccc(OC)cc2N(C)C(=O)c3cccnc13	2100	nM	1712395
CHEMBL177174	COCc1cc(CCc2oc3ccccc3n2)c(O)nc1C	2100	nM	7683054
CHEMBL440879	CC(C)c1cccc(c1)C23SCCN2C(=O)c4ccccc34	2100	nM	7689109
CHEMBL356173	CCOc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	2100	nM	8978855
CHEMBL38744	Cc1ccc(cc1)C(OCCn2c(C)ncc2[N+](=O)[O-])c3ccccc3	2100	nM	10698447
CHEMBL315287	CC(c1ccccc1)c2cc(O)nc(SC3CCCC3)n2	2100	nM	11472208
CHEMBL193952	CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C(=O)NC1=O	2100	nM	15686877
CHEMBL66704	CC1CN(CC2CC2)Cc3cc(Cl)cc4NC(=S)N1c34	2180	nM	8667357
CHEMBL299002	CCCN1C(=S)c2ccccc2Oc3ccccc13	2200	nM	1375293
CHEMBL145272	O=C1Nc2c(Cn3cccn3)ccnc2N(C4CC4)c5ncccc15	2200	nM	7490733
CHEMBL322539	CC(C)CSc1nc(O)c(C)c(Cc2ccccc2)n1	2200	nM	7650679
CHEMBL85830	CCc1cc(NCc2ccccc2C)c(O)nc1C	2200	nM	7678654
CHEMBL36776	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(OS(=O)(=O)C)cc4[nH]3	2200	nM	7684450
CHEMBL312172	O=C1N2CCCSC2(c3ccccc3)c4ccccc14	2200	nM	7689109
CHEMBL424141	CCNc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	2200	nM	8978855
CHEMBL356247	S=C(NCCc1c[nH]c2ccccc12)Nc3nccs3	2200	nM	11229762
CHEMBL372715	CN1N=C(N)c2cn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c4nnnc1c24	2200	nM	15916436
CHEMBL66043	CC1C(C)N2C(=S)Nc3cccc(CN1CC=C(C)C)c23	2220	nM	8667357
CHEMBL48427	Cc1cccc(n1)N2C(SCC2=O)c3c(Cl)cccc3Cl	2240	nM	12431069
CHEMBL435216	Cc1nc(CCCCCOCc2ccccc2)n3nc(Cl)ccc13	2300	nM	7504733
CHEMBL43348	Cc1ncc([N+](=O)[O-])n1CCOC(c2ccccc2)c3ccc(F)cc3	2300	nM	10698447
CHEMBL85368	CC(C)Sc1nc(O)cc(n1)C(C)c2ccccc2	2300	nM	11472208
CHEMBL87569	CCC(c1ccccc1)c2cc(O)nc(SC(C)C)n2	2300	nM	11472208
CHEMBL355113	Clc1ccc(cc1)N(C(=S)OCCN2C(=O)c3ccccc3C2=O)C(=O)c4occc4	2300	nM	12593657
CHEMBL35109	O\C(=C/C(=O)c1nn[nH]n1)\c2c[nH]c3ccc(Cl)cc23	2300	nM	15634005
CHEMBL207575	COC(=O)C1=C([C@H]2c3ccccc3S[C@@]12C(=O)OC)N4CCC[C@@H]4C	2300	nM	16527484
CHEMBL421246	CC(C)Nc1cccnc1N(C2CC2)C3CCN(CC3)C(=O)c4cc5ccccc5[nH]4	2310	nM	8809165
CHEMBL269591	Cc1nn(c2ccccc2)c(c1CC#N)c3ccccc3	2310	nM	10715167
CHEMBL1309	Oc1cc(Cl)cc2c1NC(=O)O[C@]2(C#CC3CC3)C(F)(F)F	2341	nM	11266155
CHEMBL125052	CCc1cc(NCc2oc(cn2)c3ccccc3)c(O)nc1C	2350	nM	1279173
CHEMBL132489	COC(=O)NCCC=C(c1cc(Br)c(OC)c(c1)C(=O)OC)c2cc(Br)c(OC)c(c2)C(=O)OC	2390	nM	11708913
CHEMBL1788126	[Na+].[Na+].CCCCCCCCCCCCCCCC(=O)Oc1cc(cc2cc(cc(OC(=O)CCCCCCCCCCCCCCC)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	2400	nM	1282569
CHEMBL143976	CCN1c2nc(\C=C\C(=O)N)ccc2N(C)C(=O)c3cccnc13	2400	nM	7490732
CHEMBL109389	CCC(C)Sc1nc(O)c(C)c(Cc2ccccc2)n1	2400	nM	7650679
CHEMBL101348	Clc1cnc(NC(=S)NCCc2ccccc2)s1	2400	nM	8523406
CHEMBL288062	CCN1c2ncccc2c3ncc(C)n3c4ccc(nc14)N(C)C	2400	nM	8648604
CHEMBL3143796	CNC(=O)CCCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	2400	nM	16220981
CHEMBL3414872	NC(=O)c1ccc(cc1)c2ccc(Cc3ccc4C(=O)N(O)C(=O)Cc4c3)cc2	2400	nM	25522204
CHEMBL342794	Cc1cccc(OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23)c1	2430	nM	7490733
CHEMBL65800	CCCN1CCN2C(=S)Nc3cccc(C1C)c23	2430	nM	8667357
CHEMBL173529	CCc1cc(CCc2ccc3ccccc3n2)c(O)nc1C	2450	nM	7683054
CHEMBL346356	Oc1cc2NC(=O)OC(C#CC3CC3)(c2cc1Cl)C(F)(F)F	2450	nM	11266155
CHEMBL338826	CCc1cc(NCc2nc(O)c3ccccc3n2)c(O)nc1C	2500	nM	1279173
CHEMBL145004	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4ccccc4OC	2500	nM	7490732
CHEMBL123202	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4ccnc4C	2500	nM	7504733
CHEMBL110857	CC(C)Sc1nc(O)c(C)c(Cc2ccccc2)n1	2500	nM	7650679
CHEMBL110007	CSc1nc(O)c(C)c(Cc2cccc(C)c2)n1	2500	nM	7650679
CHEMBL109551	CC(C)Sc1nc(O)c(C)c(Cc2cccc(C)c2)n1	2500	nM	7650679
CHEMBL415871	COC(=O)Nc1ccc2[nH]c(cc2c1)C(=O)N3CCN(CC3)c4ncccc4NC(C)C	2500	nM	7684450
CHEMBL254840	CCCCc1csc(NC(=S)NCCc2ccccc2)n1	2500	nM	8523406
CHEMBL135662	Cc1cc2nn(CC\N=C(/S)\Nc3ccc(Br)cn3)nc2cc1C	2500	nM	8863804
CHEMBL116350	Brc1ccc(NC(=S)NCCc2c[nH]c3ccccc23)nc1	2500	nM	8863804
CHEMBL133250	COc1ccc2[nH]cc(CC\N=C(/S)\Nc3ccc(Br)cn3)c2c1	2500	nM	8863804
CHEMBL321765	CCN1c2ncccc2N(C)C(=O)c3cc(CCO)cnc13	2500	nM	9685235
CHEMBL350396	Clc1ccc(cc1)N(C(=S)OCCN2C(=O)c3ccccc3C2=O)C(=O)c4cccs4	2500	nM	12593657
CHEMBL3414874	ON1C(=O)Cc2cc(Cc3ccc(cc3)c4ccc(cc4C(F)(F)F)C(F)(F)F)ccc2C1=O	2500	nM	25522204
CHEMBL31455	FC(F)(F)C1(OCC(=O)Nc2ccc(Cl)cc12)C#Cc3cocc3	2510	nM	11378361
CHEMBL126216	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4cnnc4	2600	nM	7504733
CHEMBL110008	Cc1cccc(Cc2cc(O)nc(SC3CCCCC3)n2)c1	2600	nM	7650679
CHEMBL110009	Cc1cccc(Cc2cc(O)nc(SC3CCCC3)n2)c1	2600	nM	7650679
CHEMBL335202	Clc1ccc(NC(=S)NCCc2occc2C#N)nc1	2600	nM	8863804
CHEMBL88459	OC(=O)c1cc(Cl)ccc1NC(=O)CCCCCC(=O)Nc2ccc(Cl)cc2C(=O)O	2600	nM	9873592
CHEMBL133469	CC(C)Cc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	2600	nM	10514284
CHEMBL85949	CC(c1cc(O)nc(SC2CCCCC2)n1)c3cccc4ccccc34	2600	nM	11472208
CHEMBL147336	Oc1cc(cc(O)c1O)C(=O)OC2COc3ccccc3C2	2600	nM	11844664
CHEMBL85312	O=C1N2CCSC2(c3cccs3)c4ccccc14	2650	nM	7689109
CHEMBL105826	CCc1cc(c(O)nc1C)C(OCc2ccc(Cl)cc2Cl)(C#CC3CC3)C(F)(F)F	2696	nM	11212098
CHEMBL124328	CCc1cc(NCc2oc3ccc4ccccc4c3n2)c(O)nc1C	2700	nM	1279173
CHEMBL32469	CCC(C)Sc1nc(O)c(C)c(Cc2cccc(C)c2)n1	2700	nM	7650679
CHEMBL43283	CCN1c2ncccc2c3ncc(C)n3c4ccc(nc14)N5CCC=CC5	2700	nM	8648604
CHEMBL151192	CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	2700	nM	8978855
CHEMBL292464	COc1ccccc1Sc2cccc(N)c2C#N	2700	nM	11384233
CHEMBL3414866	ON1C(=O)Cc2cc(Cc3ccc(cc3)c4cccs4)ccc2C1=O	2700	nM	25522204
CHEMBL114404	Oc1cc(Cc2ccccc2)nc(SC3CCCC3)n1	2800	nM	7650679
CHEMBL386338	COC(=O)CCC\C=C(\c1cccc(c1)C#N)/c2cc(C)c3OC(=O)N(C)c3c2	2800	nM	16913721
CHEMBL50019	Cc1ccnc(c1)N2C(SCC2=O)c3c(F)cccc3F	2840	nM	12431069
CHEMBL124946	Cc1cc(C)c(NCc2oc3c(Cl)ccc(Cl)c3n2)c(O)n1	2850	nM	1279173
CHEMBL359315	Cc1cccc(n1)N2C(SCC2=O)c3c(C)cccc3F	2850	nM	12431069
CHEMBL393003	Fc1cccc(F)c1CN2C(=O)Nc3ccc(Cl)cc23	2860	nM	15857150
CHEMBL318562	CCN1c2ncc(CCc3ccc4ccccc4c3)cc2C(=O)N(C)c5ccc(Cl)nc15	2880	nM	9685235
CHEMBL306079	CCN1c2ccccc2N(C)C(=O)c3ccc(F)nc13	2900	nM	1712395
CHEMBL111368	CC(C)Sc1nc(O)cc(Cc2cccc(C)c2)n1	2900	nM	7650679
CHEMBL37722	CN1C(=O)c2cccnc2N(CCF)c3ncccc13	2900	nM	11170624
CHEMBL296589	Cc1cccc(n1)N2C(SCC2=O)c3c(F)cccc3F	2900	nM	12431069
CHEMBL3143764	COCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	2900	nM	16220981
CHEMBL3414860	ON1C(=O)Cc2cc(Cc3ccc(Cl)cc3)ccc2C1=O	2900	nM	25522204
CHEMBL340193	CN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NCC5CC5	2910	nM	8809165
CHEMBL133393	COC(=O)c1cc(cc(C)c1OC)C(=CCCNC(=O)OCC(C)C)c2cc(C)c(OC)c(c2)C(=O)OC	2950	nM	11708913
CHEMBL39343	OCc1ccnc2N(C3CC3)c4ncccc4C(=O)Nc12	3000	nM	7490733
CHEMBL338823	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(N)ccc13	3000	nM	7504733
CHEMBL126811	Cc1nc(CCCCCCCC(=O)c2ccccc2)n3nc(Cl)ccc13	3000	nM	7504733
CHEMBL114292	Oc1cc(Cc2ccccc2)nc(SC3CCCCC3)n1	3000	nM	7650679
CHEMBL176587	CCc1cc(\C=C/c2oc3ccccc3n2)c(O)nc1C	3000	nM	7683054
CHEMBL99844	CCN1c2ncccc2N(C)C(=O)c3cc(\C=C\c4ccncc4)cnc13	3000	nM	9685235
CHEMBL156109	CSc1nc(O)cc(Cc2c(Cl)cccc2Cl)n1	3000	nM	10052969
CHEMBL345252	CC(=O)NC1=CC(=O)c2ccc(nc2C1=O)c3[nH]c(cc4c5ccccc5nc34)C(=O)OCCOP(=O)(O)O	3000	nM	14667230
CHEMBL3143760	COC(=O)CN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	3000	nM	16220981
CHEMBL144476	Clc1ccccc1OCc2ccnc3N(C4CC4)c5ncccc5C(=O)Nc23	3050	nM	7490733
CHEMBL338435	CN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4NC(C)(C)C	3100	nM	8978855
CHEMBL3143792	CNC(=O)CN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	3100	nM	16220981
CHEMBL3143768	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCO)C1=O	3100	nM	16220981
CHEMBL379794	C[C@H](NC(=O)CN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)O	3100	nM	16884295
CHEMBL3414869	COc1ccc(cc1)c2ccc(Cc3ccc4C(=O)N(O)C(=O)Cc4c3)cc2	3100	nM	25522204
CHEMBL144794	CCN1c2ncccc2C(=O)N(C)c3ccc(nc13)c4ccc(OC)cc4	3200	nM	7490732
CHEMBL147224	CCOc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	3200	nM	8978855
CHEMBL145842	CCC1(CCCC=C(c2cc(Cl)c(OC)c(CO)c2)c3cc(Cl)c(OC)c(CO)c3)OCCO1	3200	nM	10579849
CHEMBL357658	CCNC(=O)OCCCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	3200	nM	10579849
CHEMBL144209	COC(=O)c1cc(cc(Cl)c1OC)C(=CCC2OCCO2)c3cc(Cl)c(OC)c(c3)C(=O)OC	3200	nM	10579849
CHEMBL63497	CCCCCC=C(c1ccc(OC)c(c1)C(=O)OC)c2ccc(OC)c(c2)C(=O)OC	3200	nM	11708913
CHEMBL264587	CNC(=O)CCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	3200	nM	16884295
CHEMBL1161627	CC1=CN([C@H]2C[C@H](O)[C@@](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)(O2)C#C)C(=O)NC1=O	3280	nM	15686877
CHEMBL305840	CCN1C(=O)c2ccccc2N(C)c3nc(Cl)ccc13	3300	nM	1712395
CHEMBL32460	FC(F)(F)C1(OCC(=O)Nc2ccc(Cl)cc12)C#Cc3ccccc3	3300	nM	11378361
CHEMBL66404	CC1Cn2c(O)nc3cccc(CN1CC=C(C)C)c23	3320	nM	8667357
CHEMBL124610	CCC(C)(C)Nc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	3330	nM	8809165
CHEMBL124271	CNc1ccc2c(C)nc(CCCCCCC(=O)c3ccccc3)n2n1	3400	nM	7504733
CHEMBL338302	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)n4cccn4	3400	nM	7504733
CHEMBL33238	Cc1cccc(Cc2nc(SC3CCCC3)nc(O)c2C)c1	3400	nM	7650679
CHEMBL112949	Cc1c(O)nc(SC2CCCC2)nc1Cc3ccccc3	3400	nM	7650679
CHEMBL367204	Cc1nc(O)c(CCc2oc3ccccc3n2)cc1CO	3400	nM	7683054
CHEMBL151316	CCOc1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	3400	nM	8978855
CHEMBL209842	CCC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)NC1=O	3400	nM	16884295
CHEMBL84486	O=C1N2CCSC2(c3ccccc3)c4ncccc14	3450	nM	7689109
CHEMBL313676	S=C1N2CCSC2(c3ccccc3)c4ccccc14	3500	nM	7689109
CHEMBL54698	Nc1cccc(Sc2cc(Cl)ccc2Cl)c1C#N	3500	nM	11384233
CHEMBL3143793	CN(C)C(=O)CN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	3500	nM	16220981
CHEMBL212649	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C(=C3N)I)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)NC1=O	3500	nM	16884295
CHEMBL315933	COc1ccc2C(=O)N3CCSC3(c4ccccc4)c2c1	3600	nM	7689109
CHEMBL63150	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCCO)c2cc(Cl)c(OC)c(c2)C(=O)OC	3600	nM	9622549
CHEMBL367508	Nc1ccc([C@@H]2CS[C@H](OP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)c(O)n1	3600	nM	10072683
CHEMBL340286	Oc1nc2CCCCc2cc1NCN3C(=O)c4ccccc4C3=O	3700	nM	1279172
CHEMBL1788125	[Na+].CCCCCCCCCCCCCCCC(=O)Nc1cc(cc2cc(cc(O)c12)S(=O)(=O)[O-])S(=O)(=O)O	3700	nM	1282569
CHEMBL82439	CCc1cc(CCN2C(=O)c3ccccc3C2=O)c(O)nc1C	3700	nM	1716683
CHEMBL86062	CCC(c1ccccc1)c2cc(O)nc(SC3CCCCC3)n2	3700	nM	11472208
CHEMBL84821	CCc1cc(NCc2cccc(C)c2OC)c(O)nc1C	3800	nM	7678654
CHEMBL313518	OC(=O)c1cc(Br)ccc1NC(=O)CCCCCC(=O)Nc2ccc(Br)cc2C(=O)O	3800	nM	9873592
CHEMBL212868	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N=C(N)N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)NC1=O	3800	nM	16884295
CHEMBL263515	CC(C)[C@H](N)C(=O)NCC(=O)NCCCN1C(=O)N(C=C(C)C1=O)C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C	3800	nM	16913724
CHEMBL328046	Oc1cc(O)c2CC(COc2c1)OC(=O)c3ccc(O)c(O)c3O	3830	nM	11591519
CHEMBL107899	CCc1cc(c(O)nc1C)C(OCc2cc(OC)cc(OC)c2)(C#CC3CC3)C(F)(F)F	3843	nM	11212098
CHEMBL332351	Cc1nc(CCCCCC(=O)Cc2ccccc2)n3nc(Cl)ccc13	3900	nM	7504733
CHEMBL38088	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(cc4[nH]3)C#N	3900	nM	7684450
CHEMBL320902	S=C(NCCc1ccccc1)Nc2cnccn2	3900	nM	8523406
CHEMBL431931	CCN1c2ncccc2c3nccn3c4ccc(nc14)N5CCC=CC5	3900	nM	8648604
CHEMBL341880	CC(=O)Nc1c(O)ncc(C)c1Sc2cc(C)cc(C)c2	4000	nM	7473595
CHEMBL140048	Cc1cccc(Sc2c(C)cnc(O)c2N)c1	4000	nM	7473595
CHEMBL126931	CCC(=O)Nc1c(O)ncc(C)c1Sc2cc(C)cc(C)c2	4000	nM	7473595
CHEMBL344562	CCN1c2nc(OC)cc(COc3ccccc3)c2NC(=O)c4cccnc14	4000	nM	7490733
CHEMBL7483	CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4ccccc4[nH]3	4000	nM	7684450
CHEMBL84260	Clc1ccc(cc1)C23SCCN2C(=O)c4ccccc34	4000	nM	7689109
CHEMBL82751	Clc1ccc(cc1Cl)C23SCCN2C(=O)c4ccccc34	4000	nM	7689109
CHEMBL314054	COc1ccc2c(c1)C(=O)N3CCSC23c4ccccc4	4000	nM	7689109
CHEMBL92810	FC(F)(F)c1ccc(\N=C(/S)\NCCC2=CCCCC2)nc1	4000	nM	10509923
CHEMBL213257	CC1=CN(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCNC(=O)[C@@H]4CCCN4C(=O)[C@@H](N)CC(=O)N)C1=O	4000	nM	16913724
CHEMBL85783	Cc1cccc(n1)C23SCCN2C(=O)c4ccccc34	4100	nM	7689109
CHEMBL88591	OC(=O)c1cc(I)ccc1NC(=O)CCCCC(=O)Nc2ccc(I)cc2C(=O)O	4100	nM	9873592
CHEMBL133779	Oc1ccc(F)c(C2CC2NC(=O)Nc3ccc(Cl)cn3)c1Cl	4100	nM	10514285
CHEMBL150025	Cc1cc(C)nc(c1)N2C(SCC2=O)c3c(F)cccc3F	4120	nM	12431069
CHEMBL151152	Cc1ccnc(c1)N2C(SCC2=O)c3c(F)cccc3Cl	4120	nM	12431069
CHEMBL109637	Cc1c(O)nc(SC2CCCCC2)nc1Cc3ccccc3	4300	nM	7650679
CHEMBL108944	CC(C)SC1=N\C(=C\c2ccccc2)\C(C)(C)C(=O)N1	4300	nM	7650679
CHEMBL320735	CCC(C)SC1=N\C(=C\c2ccccc2)\C(C)(C)C(=O)N1	4300	nM	7650679
CHEMBL417331	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(OCc5ccccc5)ccc4[nH]3	4300	nM	7684450
CHEMBL58711	C[C@H]1CN2C(=S)Nc3ccc(Cl)c(CN1CC=C(C)C)c23	4300	nM	9857095
CHEMBL387278	CCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	4300	nM	16884295
CHEMBL125867	CCc1cc(NCc2cc3ccccc3[nH]2)c(O)nc1C	4365.16	nM	8831772
CHEMBL286325	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(F)cc4[nH]3	4400	nM	7684450
CHEMBL380100	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCN)C1=O	4400	nM	16884295
CHEMBL212339	CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C	4400	nM	16913724
CHEMBL133678	COC(=O)NCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	4430	nM	11708913
CHEMBL54444	Cc1ccccc1S(=O)(=O)c2cccc(N)c2C#N	4466.84	nM	15916427
CHEMBL82461	Clc1cc2C(=O)N3CCSC3(c4ccccc4)c2cc1Cl	4480	nM	7689109
CHEMBL107562	COC(=O)CSc1nc(O)c(C(C)C)c(Cc2cccc3ccccc23)n1	4490	nM	15149669
CHEMBL70324	CCN1c2cc(N)ccc2N(C)C(=O)c3cccnc13	4500	nM	1712395
CHEMBL85758	Nc1ccc2C(=O)N3CCSC3(c4ccccc4)c2c1	4500	nM	7689109
CHEMBL145260	S=C(NCCCc1ccccc1)Nc2nccs2	4500	nM	8523406
CHEMBL3143798	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(C\C=C\CO)C1=O	4500	nM	16220981
CHEMBL3350647	CC1C(=O)NC(=O)N([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COCP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C1=C	4600	nM	1697345
CHEMBL111088	CC(C)CSC1=N\C(=C\c2ccccc2)\C(C)(C)C(=O)N1	4600	nM	7650679
CHEMBL111118	CC(C)CSc1nc(O)c(C)c(Cc2cccc(C)c2)n1	4600	nM	7650679
CHEMBL85476	CCc1cc(NCc2ccccc2O)c(O)nc1C	4600	nM	7678654
CHEMBL314103	Cc1ccnc(c1)C23SCCN2C(=O)c4cccnc34	4600	nM	7689109
CHEMBL86268	Nc1cccc(c1)C23SCCN2C(=O)c4ccccc34	4600	nM	7689109
CHEMBL378037	CC(C)C[C@H](NC(=O)[C@@H](N)C(C)C)C(=O)NCCCN1C(=O)N(C=C(C)C1=O)C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C	4600	nM	16913724
CHEMBL58865	CC(C)C#CC1(NS(=O)(=O)Nc2ccc(Cl)cc12)C3CC3	4627	nM	10673109
CHEMBL3142917	[Na+].COC(=O)P(=O)([O-])OCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	4700	nM	15189038
CHEMBL380211	CC1=CN(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCNC(=O)[C@@H]4CCCN4C(=O)[C@@H](N)CCCCN)C1=O	4700	nM	16913724
CHEMBL110328	CCc1c(O)nc(SCC(=O)OC)nc1Cc2cccc3ccccc23	4720	nM	15149669
CHEMBL55998	Nc1cccc([S+]([O-])c2cccc(Br)c2)c1C#N	4786.3	nM	15916427
CHEMBL124246	Cc1nc(CCCCCC(=O)c2ccccc2)n3nc(Cl)ccc13	4800	nM	7504733
CHEMBL148532	CC(C)(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	4800	nM	8978855
CHEMBL35655	CSCSc1nc(O)c(C(C)C)c(Cc2cc(C)cc(C)c2)n1	4800	nM	9873370
CHEMBL345128	CCC(C)Sc1nc(O)cc(Cc2ccc(Cl)cc2)n1	4800	nM	10052969
CHEMBL379255	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C(=C3N)\C=C\CO)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)NC1=O	4800	nM	16884295
CHEMBL214795	CC(C)[C@H](N)C(=O)N1C[C@H](O)[C@H](O)[C@H]1C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C	4800	nM	16913724
CHEMBL109721	CSc1nc(O)c(C)c(Cc2ccccc2)n1	4900	nM	7650679
CHEMBL347244	Cc1c(O)nc(SC2CCCCC2)nc1Cc3c(Cl)cccc3Cl	4900	nM	10052969
CHEMBL343398	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCC=O)c2cc(Cl)c(OC)c(c2)C(=O)OC	4900	nM	10579849
CHEMBL432812	Brc1ccc(NC(=S)NCCN2CCCC2)nc1	4900	nM	10617082
CHEMBL130316	COC(=O)NCCC=C(c1cc(C)c(OC)c(c1)C(=O)OC)c2cc(C)c(OC)c(c2)C(=O)OC	4930	nM	11708913
CHEMBL151077	CCOC(=O)c1cccn1S(=O)(=O)c2cc(C)ccc2[N+](=O)[O-]	5000	nM	8558522
CHEMBL327832	CCC1(CC=C)Oc2ccccc2n3cccc3C1=O	5000	nM	8709096
CHEMBL316094	CC1(Sc2ccccc2n3cccc3C1=O)c4ccccc4	5000	nM	8709096
CHEMBL295567	CCS(=O)(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	5000	nM	10937734
CHEMBL48735	FC(F)(F)C1(C#CC2CC2)N(C(=O)c3ccccc3)c4ccccc4NC1=O	5000	nM	10937734
CHEMBL48255	CC(C)S(=O)(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	5000	nM	10937734
CHEMBL299788	CCCS(=O)(=O)N1c2ccccc2NC(=O)C1(C#CC3CC3)C(F)(F)F	5000	nM	10937734
CHEMBL84217	Cc1ccc(cc1)S(=O)(=O)c2c([nH]c3ccc(Cl)cc23)C(=O)N	5000	nM	12773052
CHEMBL283950	NC(=O)c1[nH]c2ccc(Cl)cc2c1S(=O)(=O)c3ccccc3	5000	nM	12773052
CHEMBL205041	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3ccc(cc3)[N+](=O)[O-]	5000	nM	16503141
CHEMBL205094	Cc1cc(C)c(c(C)c1)n2nnnc2SCC(=O)Nc3c(Cl)cccc3Cl	5000	nM	16503141
CHEMBL212867	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC4CO4)C1=O	5000	nM	16884295
CHEMBL3414867	ON1C(=O)Cc2cc(Cc3ccc(cc3)c4ccc(F)cc4)ccc2C1=O	5000	nM	25522204
CHEMBL53684	Nc1cccc(c1C#N)S(=O)(=O)c2ccccc2F	5011.87	nM	15916427
CHEMBL377493	COC(=O)C1=C(C2c3ccccc3SC12C(=O)OC)N4CC=CC4	5100	nM	16527484
CHEMBL280527	CCNc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(OC)ccc4[nH]3	5200	nM	7684450
CHEMBL370921	Oc1nc2ccc(Cl)cc2n1Cc3ccc4ccccc4c3	5200	nM	15857150
CHEMBL378474	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCN(CC(=O)O)CC(=O)O)C1=O	5200	nM	16884295
CHEMBL432894	Nc1cccc(c1C#N)S(=O)(=O)c2cccc(c2)C(F)(F)F	5248.07	nM	15916427
CHEMBL86064	CCc1cc(NCc2ccccc2)c(O)nc1C	5330	nM	1279173
CHEMBL172773	CCc1cc(CCC(=O)Nc2ccccc2O)c(O)nc1C	5400	nM	7683054
CHEMBL379337	COC(=O)C(=O)NC1=CS(=O)(=O)O[C@@]12[C@@H](COCc3ccccc3)O[C@H]([C@@H]2O[Si](C)(C)C(C)(C)C)N4C=C(C)C(=O)N(C)C4=O	5400	nM	16884295
CHEMBL383894	CC(C)[C@H](N)C(=O)N[C@@H](C)C(=O)NCCCN1C(=O)N(C=C(C)C1=O)C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C	5400	nM	16913724
CHEMBL37888	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(OS(=O)(=O)C)ccc4[nH]3	5500	nM	7684450
CHEMBL151315	Oc1cc(O)c2CC(COc2c1)OC(=O)c3cc(O)c(O)c(O)c3	5500	nM	11844664
CHEMBL34542	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(ccc4[nH]3)N(C)S(=O)(=O)C	5600	nM	7684450
CHEMBL63982	CCCCCC1OC1(c2cc(Br)c(OC)c(c2)C(=O)OC)c3cc(Br)c(OC)c(c3)C(=O)OC	5600	nM	9622549
CHEMBL40642	CSCSc1cc(Cc2ccccc2)c(C(C)C)c(O)n1	5600	nM	10386942
CHEMBL320702	CCc1c(O)nc(SCC(=O)c2ccc(C)cc2)nc1Cc3cccc4ccccc34	5620	nM	15149669
CHEMBL44392	CCN1c2ncccc2c3nc(CC)c(C)n3c4cccnc14	5630	nM	8648604
CHEMBL130336	COC(=O)c1cc(cc(C)c1OC)C(=CCCCC(=O)N(C)C)c2cc(C)c(OC)c(c2)C(=O)OC	5650	nM	11708913
CHEMBL198201	COC(=O)CCC\C=C(/c1cccc(c1)C#N)\c2cc(C)c3onc(OC)c3c2	5700	nM	16162014
CHEMBL51912	Cc1ccc(Sc2cccc(N)c2C#N)cc1	5754.4	nM	15916427
CHEMBL58119	C[C@H]1Cn2c(S)nc3ccc(F)c(CN1CC=C(C)C)c23	5800	nM	9857095
CHEMBL288626	Brc1ccc(NC(=S)NCN2CCCCC2)nc1	5800	nM	10386942
CHEMBL86289	CC(C)Sc1nc(O)cc(n1)C(C)c2cccc3ccccc23	5800	nM	11472208
CHEMBL153896	CCCCOC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4ccc5C(=O)C=C(NC(=O)CCC)C(=O)c5n4	5800	nM	14667230
CHEMBL108396	COc1ccc(cc1)C(=O)CSC2=NC(=C(C(C)C)C(=O)N2)Cc3cccc4ccccc34	5820	nM	15149669
CHEMBL314558	O=C1N2CCSC2(c3ccccn3)c4ccccc14	5850	nM	7689109
CHEMBL301086	Nc1cccc(c1C#N)S(=O)(=O)c2ccccc2Cl	5888.44	nM	15916427
CHEMBL175037	CCc1cc(\C=C\c2oc3ccccc3n2)c(O)nc1C	5900	nM	7683054
CHEMBL325757	COC(=O)c1cc(cc(Br)c1OC)C(=CCCCC#C)c2cc(Br)c(OC)c(c2)C(=O)OC	6000	nM	11708913
CHEMBL298823	Nc1cccc(c1C#N)S(=O)(=O)c2ccccc2C#N	6025.6	nM	15916427
CHEMBL104738	CCc1cc(c(O)nc1C)C(OCc2c(F)cccc2Cl)(C#CC3CC3)C(F)(F)F	6093	nM	11212098
CHEMBL111523	CSC1=N\C(=C\c2ccccc2)\C(C)(C)C(=O)N1	6100	nM	7650679
CHEMBL313729	O=C1N2CCOC2(c3ccccc3)c4ccccc14	6100	nM	7689109
CHEMBL317072	CCN1c2ncccc2N(C)C(=O)c3cc(CCC(=O)N)cnc13	6100	nM	9685235
CHEMBL35755	CSCSc1nc(O)c(C(C)C)c(Cc2ccccc2)n1	6100	nM	9873370
CHEMBL292012	Nc1cccc([S+]([O-])c2cc(Cl)ccc2Cl)c1C#N	6165.95	nM	15916427
CHEMBL125615	CCC1=C(C)NC(OC)C(=C1)CCN2C(=O)c3ccccc3C2=O	6200	nM	1279172
CHEMBL187438	CCCc1c(O)nc2ccc(Cl)cc2c1[S+]([O-])C3CCCCC3	6200	nM	15537346
CHEMBL85280	Cc1ccccc1C23SCCN2C(=O)c4ccccc34	6300	nM	7689109
CHEMBL287978	Fc1ccc(CC\N=C(/S)\Nc2ccc(Br)cn2)cc1	6400	nM	10636251
CHEMBL308549	CSCN1c2ccccc2N(C)C(=O)c3cccnc13	6600	nM	1712395
CHEMBL82909	Cc1cccc(n1)C23SCCN2C(=O)c4cccnc34	6600	nM	7689109
CHEMBL3143767	CN(C)CCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	6600	nM	16220981
CHEMBL3142813	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC(=O)O)C1=O	6600	nM	16884295
CHEMBL438175	CC(C)[C@H](N)C(=O)N1CCC[C@H]1C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C	6600	nM	16913724
CHEMBL262415	Cc1nc(CCCCCCC(=O)c2ccccc2)n3nc(ccc13)N4CCCCC4	6700	nM	7504733
CHEMBL2368777	CCCN1C=Nc2c(ncn2[C@@H]3O[C@H](COC)[C@@H](OP(=O)(C)O)[C@H]3OC)C1=O	6700	nM	12723951
CHEMBL385844	CC(C)[C@H](N)C(=O)NCCCN1C(=O)N(C=C(C)C1=O)C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C	6700	nM	16913724
CHEMBL610949	CN1N=C(NC(=O)C)c2cn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c4ncnc1c24	6800	nM	10882373
CHEMBL445417	CC(C)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C	6800	nM	16913724
CHEMBL83356	CCc1ccccc1CNc2cc(CC)c(C)nc2O	6900	nM	7678654
CHEMBL151896	COC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2N	6900	nM	8558522
CHEMBL90333	CSc1ccc(NC(=O)CCCCC(=O)Nc2ccc(SC)cc2C(=O)O)c(c1)C(=O)O	6900	nM	9873592
CHEMBL55271	Nc1cccc(c1C#N)S(=O)(=O)c2ccccc2	6900	nM	11384233
CHEMBL198873	CC(C)CC(=O)c1c(O)cc(O)c2C(=CC(=O)Oc12)c3ccccc3	6900	nM	16137881
CHEMBL135760	CCOc1ccc(F)c(CC\N=C(/S)\Nc2nc(cs2)C(F)(F)F)c1Cl	7000	nM	8863804
CHEMBL290312	CSCSc1cc(Cc2cc(C)cc(C)c2)c(C(C)C)c(O)n1	7000	nM	10386942
CHEMBL108605	CCOC(=O)CSc1nc(O)c(C)c(Cc2cccc3ccccc23)n1	7000	nM	15149669
CHEMBL293963	Nc1cccc(Sc2cccc(c2)C(F)(F)F)c1C#N	7079.46	nM	15916427
CHEMBL156598	CCCCCCCCOC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4ccc5C(=O)C=C(NC=O)C(=O)c5n4	7100	nM	14667230
CHEMBL264639	COC(=O)c1cc(cc(C)c1OC)C(=CCCCC(=O)N2CCCCC2)c3cc(C)c(OC)c(c3)C(=O)OC	7120	nM	11708913
CHEMBL1460	OC[C@@H]1CC[C@@H](O1)n2cnc3C(=O)NC=Nc23	7150	nM	15149669
CHEMBL300757	Nc1cccc(Sc2ccccc2Cl)c1C#N	7200	nM	11384233
CHEMBL405279	CC1=CN(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCNC(=O)[C@@H]4CCCN4C(=O)[C@@H](N)CC(=O)O)C1=O	7200	nM	16913724
CHEMBL53896	Cc1ccc(cc1)S(=O)(=O)c2cccc(N)c2C#N	7244.36	nM	15916427
CHEMBL314625	OC(=O)c1cc(Br)ccc1NC(=O)CCCC(=O)Nc2ccc(Br)cc2C(=O)O	7300	nM	9873592
CHEMBL290125	CCC(C)Sc1nc(O)cc(Cc2ccc3ccccc3c2)n1	7400	nM	9154967
CHEMBL88151	OC(=O)c1cc(Br)ccc1NC(=O)CCCCCCC(=O)Nc2ccc(Br)cc2C(=O)O	7400	nM	9873592
CHEMBL415703	CCC(C)Sc1nc(O)cc(Cc2ccc(F)cc2)n1	7400	nM	10052969
CHEMBL85745	CCc1cc(NCc2ccc(OC)cc2)c(O)nc1C	7500	nM	7678654
CHEMBL192976	Oc1nc2ccc(Cl)cc2n1Cc3c(Cl)cccc3Cl	7500	nM	15857150
CHEMBL194923	COC(=O)CCC\C=C(/c1cccc(c1)C#N)\c2cc(Cl)ccc2OC	7580	nM	16162014
CHEMBL98394	CCc1cc(NCc2nc3ccccc3[nH]2)c(O)nc1C	7585.78	nM	8831772
CHEMBL72272	CCN1c2ccccc2N(C)C(=O)c3cc(Cl)cnc13	7600	nM	1712395
CHEMBL387003	COc1noc2c(C)cc(cc12)\C(=C/CCN3CCOC3=O)\c4cc(C)c5ON(C)C(=O)c5c4	7600	nM	16913721
CHEMBL380043	COC(=O)C1=C([C@H]2c3ccccc3S[C@@]12C(=O)OC)N4CCCCC4	7700	nM	16527484
CHEMBL3350644	CC1N([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COCP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C(=O)NC(=O)C1=C	7900	nM	1697345
CHEMBL302957	CCN1C(=O)c2cccnc2N(CC)c3cccc(C)c13	8000	nM	1712395
CHEMBL84266	Cc1cccc2c1C(=O)N3CCSC23c4ccccc4	8000	nM	7689109
CHEMBL150424	CC(C)OC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2N	8000	nM	8558522
CHEMBL610657	CC(C)C(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	8000	nM	10882373
CHEMBL23886	Nc1nc(O)c2ncn(C3CC(OCP(=O)(O)OP(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(O)nc(N)nc56)C=C3)c2n1	8000	nM	11881997
CHEMBL175880	Cc1ccc2[nH]c(nc2c1)\C(=C\c3oc(cc3)c4ccc(O)c(c4)C(=O)O)\C#N	8000	nM	15634005
CHEMBL333772	Cc1ccc(NCN2C(=O)c3ccccc3C2=O)c(O)n1	8100	nM	1279172
CHEMBL417311	CCC(C)Sc1nc(O)cc(Cc2cccc3ccccc23)n1	8100	nM	9154967
CHEMBL379994	CC1=CN(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCNC(=O)[C@@H]4CCCN4C(=O)[C@@H](N)Cc5ccc(O)cc5)C1=O	8100	nM	16913724
CHEMBL107946	Oc1ncccc1C(OCc2ccncc2)(C#CC3CC3)C(F)(F)F	8115	nM	11212098
CHEMBL196274	COC(=O)CCC\C=C(\c1cc(C)c2ON(C)C(=O)c2c1)/c3cc(Cl)ccc3OC	8200	nM	16162014
CHEMBL36479	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C(F)(F)F)ccc4[nH]3	8300	nM	7684450
CHEMBL326205	CCCOC(=O)CCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	8300	nM	11708913
CHEMBL419025	CC(C)CSc1nc(O)cc(Cc2cccc(C)c2)n1	8400	nM	7650679
CHEMBL175235	CCc1cc(CCc2ccc3ccccc3c2)c(O)nc1C	8400	nM	7683054
CHEMBL609191	CCC(=O)NC1=NN(C)c2ncnc3c2c1cn3C4O[C@H](CO)[C@@H](O)[C@H]4O	8400	nM	10882373
CHEMBL437717	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@H]([C@H](O[Si](C)(C)C(C)(C)C)[C@]12OS(=O)(=O)C=C2N)n3nncc3C(=O)N	8400	nM	16884295
CHEMBL347255	CCC(C)Sc1nc(O)c(C)c(Cc2ccc(Cl)cc2)n1	8500	nM	10052969
CHEMBL163536	O=C1c2ccccc2C34CC=CC[C@@]13c5ccccc5C4=O	8700	nM	7681480
CHEMBL89524	OC(=O)c1cc(Cl)ccc1NC(=O)CCCCC(=O)Nc2ccc(Cl)cc2C(=O)O	8700	nM	9873592
CHEMBL315965	OC(=O)c1cc(Cl)ccc1NC(=O)CCCC(=O)Nc2ccc(Cl)cc2C(=O)O	8700	nM	9873592
CHEMBL52068	Nc1cccc(Sc2ccccc2)c1C#N	8709.64	nM	15916427
CHEMBL114876	CC1=CN([C@H]2CC(F)(F)[C@@H](CO)O2)C(=O)NC1=O	8800	nM	1527788
CHEMBL210790	COC(=O)C1=C(C2c3ccccc3SC12C(=O)OC)N4CCCCC4	8900	nM	16527484
CHEMBL73568	CN1C(=O)c2cccnc2N(Cc3ccccc3)c4ccccc14	9000	nM	1712395
CHEMBL134252	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2C=C1C)c5ccccc5	9000	nM	7506311
CHEMBL264069	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC(=O)N[C@@H](CC(=O)O)C(=O)O)C1=O	9100	nM	16884295
CHEMBL59586	Nc1cccc(Sc2ccccc2C#N)c1C#N	9120.11	nM	15916427
CHEMBL323016	CCCOC(=O)CCCC=C(c1cc(Br)c(OC)c(c1)C(=O)OC)c2cc(Br)c(OC)c(c2)C(=O)OC	9150	nM	11708913
CHEMBL89744	Cc1ccc(NC(=O)CCCCC(=O)Nc2ccc(C)cc2C(=O)O)c(c1)C(=O)O	9200	nM	9873592
CHEMBL311050	Clc1ccc2NC(=O)N[C@@](C#Cc3ccccn3)(C4CC4)c2c1	9300	nM	7520079
CHEMBL109213	CC(C)CSc1nc(O)cc(Cc2ccccc2)n1	9400	nM	7650679
CHEMBL132790	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCN2CCOC2=O)c3cc(Cl)c(OC)c(c3)C(=O)OC	9470	nM	11708913
CHEMBL157342	O[C@@H]1[C@@H](O)[C@H](Oc2cc(Cl)cc3c2NC(=O)O[C@]3(C#CC4CC4)C(F)(F)F)O[C@@H]([C@H]1O)C(=O)O	9489	nM	11266155
CHEMBL2368772	COC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(=O)(C)O)n2cnc3C(=O)N(CC=C)C=Nc23	9600	nM	12723951
CHEMBL36031	CCc1c(O)nc(SCSC)nc1Cc2ccccc2	9700	nM	9873370
CHEMBL215346	COC(=O)c1cc(cc(C)c1OC)\C(=C/CCN2CCOC2=O)\c3cc(C)c4ON(C)C(=O)c4c3	9860	nM	16913721
CHEMBL63515	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCN=[N+]=[N-])c2cc(Cl)c(OC)c(c2)C(=O)OC	9900	nM	9622549
CHEMBL294212	Nc1cccc([S+]([O-])c2ccccc2C#N)c1C#N	9900	nM	11384233
CHEMBL340658	CCc1cc(NCc2oc3cc4ccccc4cc3n2)c(O)nc1C	10000	nM	1279173
CHEMBL1160257	CC1=CN([C@H]2C[C@@H](O)[C@@H](OP(=O)(O)NP(=O)(O)OP(=O)(O)O)O2)C(=O)NC1=O	10000	nM	1375962
CHEMBL142098	Cc1cccc(Sc2c(C)cnc(O)c2[N+](=O)[O-])c1	10000	nM	7473595
CHEMBL356674	Cc1cc(C)cc(Sc2c(C)cnc(O)c2[N+](=O)[O-])c1	10000	nM	7473595
CHEMBL334946	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2C(=O)[C@@H]1C)c5ccccc5	10000	nM	7506311
CHEMBL82662	[O-][N+](=O)c1ccnc(c1)C#CC2(NC(=O)Nc3ccc(Cl)cc23)C4CC4	10000	nM	7520079
CHEMBL109807	Cc1cccc(Cc2nc(S)nc(O)c2C)c1	10000	nM	7650679
CHEMBL111449	Cc1cccc(Cc2cc(O)nc(S)n2)c1	10000	nM	7650679
CHEMBL107607	CC1(C)C(=O)NC(=N/C/1=C/c2ccccc2)SC3CCCC3	10000	nM	7650679
CHEMBL111181	CC1(C)C(=O)NC(=N/C/1=C/c2ccccc2)SC3CCCCC3	10000	nM	7650679
CHEMBL419928	Cc1c(O)nc(S)nc1Cc2ccccc2	10000	nM	7650679
CHEMBL111152	CC(C)Sc1nc(O)cc(Cc2ccccc2)n1	10000	nM	7650679
CHEMBL109772	CSc1nc(O)cc(Cc2ccccc2)n1	10000	nM	7650679
CHEMBL109512	CSc1nc(O)cc(Cc2cccc(C)c2)n1	10000	nM	7650679
CHEMBL82621	CCc1cc(NCc2cnccc2OC)c(O)nc1C	10000	nM	7678654
CHEMBL84716	O=C1N2CCS(=O)(=O)C2(c3ccccc3)c4ccccc14	10000	nM	7689109
CHEMBL84213	Cc1ccc2c(c1)C(=O)N3CCSC23c4ccccc4	10000	nM	7689109
CHEMBL83012	[O-][N+](=O)c1ccc2C(=O)N3CCSC3(c4ccccc4)c2c1	10000	nM	7689109
CHEMBL82628	O=C1N2CCSC2(c3ccccc3)c4cc5ccccc5cc14	10000	nM	7689109
CHEMBL315675	O=C1N2CCCNC2(c3ccccc3)c4ccccc14	10000	nM	7689109
CHEMBL83640	CC(C)c1ccc(cc1)C23SCCN2C(=O)c4ccccc34	10000	nM	7689109
CHEMBL434323	S=C(NCCc1ccncc1)Nc2nccs2	10000	nM	8523406
CHEMBL423020	OC(=O)c1csc(\N=C(/S)\NCCc2ccccc2)n1	10000	nM	8523406
CHEMBL143112	Brc1cccnc1NC(=S)NCCc2ccccc2	10000	nM	8523406
CHEMBL144904	CC(Cc1ccccc1)\N=C(/S)\Nc2nccs2	10000	nM	8523406
CHEMBL358507	S=C(NCCc1cccnc1)Nc2nccs2	10000	nM	8523406
CHEMBL358055	S=C(NCCc1ccccc1)Nc2cc[nH]n2	10000	nM	8523406
CHEMBL103316	CN(CCc1ccccc1)\C(=N/c2nccs2)\S	10000	nM	8523406
CHEMBL359230	O=C(NCCc1ccccc1)Nc2nccs2	10000	nM	8523406
CHEMBL147442	CCCCCCOc1cccc(CC\N=C(/S)\Nc2nccs2)c1	10000	nM	8523406
CHEMBL88213	CCCC1(CC)Oc2ccccc2n3cccc3C1=O	10000	nM	8709096
CHEMBL91318	CC1(Oc2ccccc2n3cccc3C1=O)c4ccccc4	10000	nM	8709096
CHEMBL22714	Nc1nc2cc(Cl)c(Cl)cc2n1Cc3ccc(Cl)cc3	10000	nM	9548815
CHEMBL296346	Brc1ccc(NC(=S)NCN2CCOCC2)nc1	10000	nM	10386942
CHEMBL89082	Clc1ccc(\N=C(\NCCc2ccccc2)/NC#N)nc1	10000	nM	10698450
CHEMBL90204	COc1ccccc1CC\N=C(/NC#N)\Nc2nccs2	10000	nM	10698450
CHEMBL414887	Clc1cncc(NS(=O)(=O)NCCc2ccccc2)c1	10000	nM	10698450
CHEMBL87637	CCC(c1ccccc1)c2cc(O)nc(SC3CCCC3)n2	10000	nM	11472208
CHEMBL131432	CCCCCC=C(c1cc(F)c(OC)c(c1)C(=O)OC)c2cc(F)c(OC)c(c2)C(=O)OC	10000	nM	11708913
CHEMBL277903	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(N)ncnc56)C=C3	10000	nM	11881997
CHEMBL53893	Cc1cccc(c1)[S+]([O-])c2cccc(N)c2C#N	10000	nM	15916427
CHEMBL210334	COC(=O)C1=C(C2c3ccccc3SC12C(=O)OC)N4CCC4	10000	nM	16527484
CHEMBL210297	OC(=O)c1ccc2c(c1)nc(c3ccc(OCc4cc(ccc4c5ccc(Cl)cc5)N6CCCC6=O)cc3F)n2C7CCCCC7	10000	nM	16854079
CHEMBL386710	CN1CCOCC1C2=NC(=C(O)C(=O)N2C)C(=O)NCc3ccc(F)cc3	10000	nM	17154493
CHEMBL386515	CN(C)C(C)(C)c1nc(O)c(O)c(n1)C(=O)NCc2ccc(F)cc2	10000	nM	17154493
CHEMBL37628	CCN1c2nccc(C)c2NC(=O)c3cccnc13	10300	nM	8648604
CHEMBL88463	COc1ccc(NC(=O)CCCCC(=O)Nc2ccc(OC)cc2C(=O)O)c(c1)C(=O)O	10600	nM	9873592
CHEMBL92138	Oc1cc2CC(CCOC(=O)c3ccc(O)c(O)c3O)COc2cc1O	10740	nM	11591519
CHEMBL122978	CCC1=C(C)N(C)C(=O)C(=C1)NCc2ccc3ccccc3c2	11000	nM	1279173
CHEMBL39505	CN1C(=O)c2cccnc2N(c3ncccc13)C(C)(C)C	11000	nM	1712395
CHEMBL341394	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@H](O)[C@H]1C)c5ccccc5	11000	nM	7506311
CHEMBL305535	CCCCCC=C(c1cc(I)c(OC)c(c1)C(=O)OC)c2cc(I)c(OC)c(c2)C(=O)OC	11000	nM	9622549
CHEMBL144654	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCCBr)c2cc(Cl)c(OC)c(c2)C(=O)OC	11000	nM	10579849
CHEMBL176113	CCc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3ccc(O)c(c3)C(=O)O)C2=O)cc1	11000	nM	15634005
CHEMBL175521	CCOc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3ccc(O)c(c3)C(=O)O)C2=O)cc1	11000	nM	15634005
CHEMBL3143763	[I-].CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCC[N+](C)(C)C)C1=O	11000	nM	16220981
CHEMBL383271	COC(=O)C1=C([C@@H]2c3ccccc3S[C@]12C(=O)OC)N4CCC[C@H]4C	11000	nM	16527484
CHEMBL363624	CC(=CCc1c(O)cc(O)c2C(=CC(=O)Oc12)c3ccccc3)C	11200	nM	16137881
CHEMBL410036	CC(=O)OCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2	11500	nM	7540209
CHEMBL214143	CN(C)C(=O)c1cnnn1[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	11700	nM	16884295
CHEMBL2112687	Nc1ncnc2c1c(C#N)c(Br)n2[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F	12000	nM	7562946
CHEMBL473686	Nc1ncnc2c1c(cn2[C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)C#N	12000	nM	7562946
CHEMBL89674	OC(=O)c1cc(ccc1NC(=O)CCCCC(=O)Nc2ccc(cc2C(=O)O)C(F)(F)F)C(F)(F)F	12000	nM	9873592
CHEMBL293780	Nc1cccc(c1C#N)S(=O)(=O)c2ccccc2Br	12000	nM	11384233
CHEMBL175939	OC(=O)c1cc(ccc1O)N2C(=O)C3C=CC(=CC3C2=O)Oc4ccc5C(=O)N(C(=O)c5c4)c6ccc(O)c(c6)C(=O)O	12000	nM	15634005
CHEMBL55747	Nc1cccc(Sc2ccc(Cl)cc2)c1C#N	12022.64	nM	15916427
CHEMBL293331	COc1ccccc1[S+]([O-])c2cccc(N)c2C#N	12022.64	nM	15916427
CHEMBL449041	Nc1cccc(Sc2cccc(F)c2)c1C#N	12022.64	nM	15916427
CHEMBL69517	CC1N(CC=C(C)C)CCN2C(=O)Nc3cccc1c23	12100	nM	8667357
CHEMBL295930	CCN1c2ncccc2c3ncc(C)n3c4c(C)cc(O)nc14	12200	nM	8648604
CHEMBL76986	CCCON1C(=O)NC(=O)C(=C1Sc2cc(C)cc(C)c2)C(C)C	12300	nM	9240351
CHEMBL83301	CCc1cc(NCc2ccccc2C(F)(F)F)c(O)nc1C	12500	nM	7678654
CHEMBL348180	Oc1cc(Cl)cc2c1NC(=O)O[C@@]2(C#CC3CC3)C(F)(F)F	12500	nM	11266155
CHEMBL346585	OS(=O)(=O)Oc1cc(Cl)cc2c1NC(=O)O[C@]2(C#CC3CC3)C(F)(F)F.c4ccncc4	12500	nM	11266155
CHEMBL69775	CC(C)C1CN(CC(=C)C)Cc2cccc3NC(=O)N1c23	12600	nM	8667357
CHEMBL312160	Oc1cccc(c1)C23SCCN2C(=O)c4ccccc34	12700	nM	7689109
CHEMBL132259	COc1c(CCNC(=O)Nc2ccc(Cl)cn2)c(F)ccc1C(=O)C	12700	nM	10514285
CHEMBL152355	CC(=O)NC1=CC(=O)c2ccc(nc2C1=O)c3[nH]c(cc4c5ccccc5nc34)C(=O)N	12700	nM	14667230
CHEMBL362924	Oc1nc2ccc(Cl)cc2n1Cc3cccc4ccccc34	12700	nM	15857150
CHEMBL55043	COc1ccc(cc1)S(=O)(=O)c2cccc(N)c2C#N	12882.5	nM	15916427
CHEMBL135235	C[C@]1(Cl)CC2=C(CCC(=O)C2)[C@H]3CC[C@@]4(C)[C@@H](CC[C@@]4(O)C#C)[C@H]13	13000	nM	8863804
CHEMBL316466	CCC(C)Sc1nc(O)c(C)c(Cc2ccc(F)cc2)n1	13000	nM	10052969
CHEMBL130177	COC(=O)c1cccnc1N(C)C2CCN(CC2)C(=O)c3cc4cc(NS(=O)(=O)C)ccc4[nH]3	13000	nM	10514284
CHEMBL417737	C[C@@H](\N=C(/S)\Nc1nccs1)C2CCCCC2	13000	nM	10999473
CHEMBL54970	COc1cc(Sc2cccc(N)c2C#N)cc(c1)C(F)(F)F	13000	nM	11384233
CHEMBL3143799	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCCO)C1=O	13000	nM	16220981
CHEMBL213365	CC1=CN(C2OC(CO[Si](C)(C)C(C)(C)C)C3(OS(=O)(=O)C=C3N)C2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCNC(=O)[C@@H]4CCCN4C(=O)CN)C1=O	13000	nM	16913724
CHEMBL346794	CC(=O)NC1=CC(=O)c2ccc(nc2C1=O)c3[nH]c(cc4c5ccccc5nc34)C(=O)O	13300	nM	14667230
CHEMBL68933	CC1C(C)n2c(S)nc3cccc(CN1CC4CC4)c23	13400	nM	8667357
CHEMBL9014	CC#Cc1c(C)nn(c2ccccc2)c1c3ccccc3	13400	nM	10715167
CHEMBL177074	CCc1cc(CCc2oc3ccncc3c2)c(O)nc1C	13500	nM	7683054
CHEMBL59279	C[C@H]1Cn2c(S)nc3ccc(C)c(CN1CC=C(C)C)c23	13600	nM	9857095
CHEMBL341238	Cc1nc(CCCCCCCc2ccccc2)n3nc(Cl)ccc13	14000	nM	7504733
CHEMBL74478	Nc1ncnc2c1ncn2\C=C\3/CC3CO	14000	nM	9438017
CHEMBL85069	OC(=O)c1cc(Br)ccc1NC(=O)c2cccc(c2)C(=O)Nc3ccc(Br)cc3C(=O)O	14000	nM	9873592
CHEMBL415959	[O-][N+](=O)c1ccccc1S(=O)(=O)c2ccccc2[N+](=O)[O-]	14000	nM	11384233
CHEMBL57223	Nc1cccc(c1C#N)S(=O)(=O)c2ccc(Br)cc2	14000	nM	11384233
CHEMBL430447	OS(=O)(=O)c1ccc2c(OC(=O)c3ccc(cc3)c4ccc(cc4)C(=O)Oc5cc(cc6cc(ccc56)S(=O)(=O)O)S(=O)(=O)O)cc(cc2c1)S(=O)(=O)O	14400	nM	7520080
CHEMBL625	c1ccc2[nH]c(nc2c1)c3cscn3	14600	nM	12431069
CHEMBL67095	CN1CC2=C(Sc3ccccc13)N(COCCOC(=O)C)C(=O)NC2=O	14700	nM	7540209
CHEMBL339138	CCc1cc(NCc2ccccn2)c(O)nc1C	15000	nM	1279173
CHEMBL265502	Cc1ccc(cc1NC(=O)c2cccc(NC(=O)Nc3cccc(c3)C(=O)Nc4cc(ccc4C)C(=O)Nc5ccc(c6cc(cc(c56)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O)c2)C(=O)Nc7ccc(c8cc(cc(c78)S(=O)(=O)O)S(=O)(=O)O)S(=O)(=O)O	15000	nM	1282569
CHEMBL82454	O=C1N2CCCC2(c3ccccc3)c4ccccc14	15000	nM	7689109
CHEMBL313804	CCC1(Sc2ccccc2n3cccc3C1=O)c4ccccc4	15000	nM	8709096
CHEMBL314121	OC(=O)c1cc(Br)ccc1NC(=O)CCCCC(=O)Nc2ccc(Br)cc2	15000	nM	9873592
CHEMBL442696	CN(C1CCN(CC1)C(=O)c2cc3cc(NS(=O)(=O)C)ccc3[nH]2)c4ncccc4CO	15000	nM	10514284
CHEMBL293553	Nc1cccc([S+]([O-])c2cccc(c2)C#N)c1C#N	15000	nM	11384233
CHEMBL56465	Nc1cccc(Sc2cccc(Br)c2)c1C#N	15000	nM	11384233
CHEMBL280273	Nc1nc(O)c2ncn(C3CC(OCP(=O)(O)OP(=O)(O)C(F)(F)P(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(O)nc(N)nc56)C=C3)c2n1	15000	nM	11881997
CHEMBL175955	OC(=O)c1cc(NC(=O)CCN2C(=S)S\C(=C/c3ccc4OCOc4c3)\C2=O)ccc1O	15000	nM	15634005
CHEMBL379599	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC(=O)O)C1=O	15000	nM	16220981
CHEMBL347211	COC(=O)c1[nH]c(c2ccc3C(=O)C=C(NC(=O)C)C(=O)c3n2)c4nc5ccccc5c4c1C	15100	nM	14667230
CHEMBL290781	CN1C(=O)c2cccnc2N(C(=O)C)c3ncccc13	15300	nM	11170624
CHEMBL198276	COC(=O)c1cc(cc(C)c1OC)\C(=C/CCN2CCOC2=O)\c3cc(F)cc(c3)C(F)(F)F	15700	nM	16162014
CHEMBL55599	Nc1cccc(Sc2cccc(Cl)c2)c1C#N	15848.93	nM	15916427
CHEMBL291558	[O-][N+](=O)c1ccccc1S(=O)(=O)c2ccccc2	15848.93	nM	15916427
CHEMBL340812	CCC1=C(C)NC(OC)C(=C1)CN2C(=O)c3ccccc3C2=O	16000	nM	1279172
CHEMBL72920	CCOC(=O)CN1c2ccccc2N(C)C(=O)c3cccnc13	16000	nM	1712395
CHEMBL176982	CCc1cc(CCCc2oc3ccccc3n2)c(O)nc1C	16000	nM	7683054
CHEMBL57772	Fc1cccc(F)c1Cn2c(nc3ccccc23)c4ccccc4	16000	nM	9435891
CHEMBL63680	COC(=O)C=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	16000	nM	9622549
CHEMBL379485	CC(C)[C@H](N)C(=O)N1C[C@H](O)C[C@H]1C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C	16000	nM	16913724
CHEMBL192499	CC(C)c1ccc(Cn2c(O)nc3ccc(Cl)cc23)cc1	16200	nM	15857150
CHEMBL313213	CCCCCCCCCCCCCCCC(=O)Nc1c(OC(=O)CCCCCCCCCCCCCCC)cc(c2ccccc12)S(=O)(=O)O	16800	nM	7520080
CHEMBL309921	O=C1N2CCSC2(c3ccccc3)c4cnccc14	17000	nM	7689109
CHEMBL315961	OC(=O)c1cc(Br)ccc1NC(=O)c2ccnc(c2)C(=O)Nc3ccc(Br)cc3C(=O)O	17000	nM	9873592
CHEMBL56870	COc1ccc(Sc2cccc(N)c2C#N)cc1	17000	nM	11384233
CHEMBL175758	COc1cc(\C=C\2/SC(=S)N(CC(=O)Nc3cc(Cl)ccc3O)C2=O)cc(OC)c1OC	17000	nM	15634005
CHEMBL176150	COc1ccc(\C=C/2\SC(=S)N(CCC(=O)Nc3ccc(C(=O)O)c(O)c3)C2=O)cc1OC	17000	nM	15634005
CHEMBL310421	FC(F)(F)c1ccc2C(=O)N3CCSC3(c4ccccc4)c2c1	17700	nM	7689109
CHEMBL292436	Nc1cccc(c1C#N)S(=O)(=O)c2ccc(cc2)C#N	18000	nM	11384233
CHEMBL132691	Fc1cccc(F)c1c2nc3ccccc3n2Cc4ccccc4	18600	nM	9435891
CHEMBL32386	CSCSc1nc(O)c(C)c(Cc2ccccc2)n1	18800	nM	9873370
CHEMBL55007	COc1cccc(c1)[S+]([O-])c2cccc(N)c2C#N	19000	nM	11384233
CHEMBL56841	Nc1cccc(Sc2ccc(cc2)C#N)c1C#N	19000	nM	11384233
CHEMBL299781	Nc1cccc([S+]([O-])c2ccccc2Br)c1C#N	19000	nM	11384233
CHEMBL3144230	NC1=NC(=O)N(C=C1)[C@H]2C[C@H](O)[C@@H](COP(=O)(O)O[C@H]3C[C@@H](O[C@@H]3COP(=O)(O)O)n4cnc5c(N)ncnc45)O2	19000	nM	15341930
CHEMBL151620	CCOC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2NC(=O)C	20000	nM	8558522
CHEMBL151411	CCOC(=O)c1cccn1S(=O)(=O)c2cc(C)ccc2N	20000	nM	8558522
CHEMBL357327	CCOC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2NC=O	20000	nM	8558522
CHEMBL146981	CCOC(=O)CC(=O)Nc1ccc(Cl)cc1S(=O)(=O)n2cccc2C(=O)OCC	20000	nM	8558522
CHEMBL148764	CCOC(=O)c1cccn1S(=O)(=O)c2cc(Cl)ccc2NC(=O)CC	20000	nM	8558522
CHEMBL25270	Nc1nc2cc(Cl)c(Cl)cc2n1Cc3ccc(cc3)C(F)(F)F	20000	nM	9548815
CHEMBL54487	COc1ccc(cc1)[S+]([O-])c2cccc(N)c2C#N	20000	nM	11384233
CHEMBL56895	[O-][N+](=O)c1ccccc1Sc2ccccc2[N+](=O)[O-]	20000	nM	11384233
CHEMBL23428	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)C(F)(F)P(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(N)ncnc56)C=C3	20000	nM	11881997
CHEMBL176083	Oc1ccc(cc1NC(=O)CN2C(=S)S\C(=C/c3ccccc3Cl)\C2=O)[N+](=O)[O-]	20000	nM	15634005
CHEMBL192310	Fc1cccc(F)c1CN2C(=O)Oc3ccc(Cl)cc23	20000	nM	15857150
CHEMBL191910	Ic1ccc(NC(=S)OCCN2C(=O)c3ccccc3C2=O)cc1	20000	nM	15916438
CHEMBL381263	CCOC(=O)C1=C([C@@H]2c3ccccc3S[C@]12C(=O)OCC)N4CCCC4	20000	nM	16527484
CHEMBL383093	CCOC(=O)C1=C(C2c3ccccc3SC12C(=O)OCC)N4CCCC4	20000	nM	16527484
CHEMBL381800	CC(C)(C)OC(=O)C1=C(C2c3ccccc3SC12C(=O)OC(C)(C)C)N4CCCC4	20000	nM	16527484
CHEMBL378599	COC(=O)C1=C([C@@H]2c3ccccc3S[C@]12C(=O)OC)N4CCCC4	20000	nM	16527484
CHEMBL206630	CCOC(=O)C1=C([C@H]2c3ccccc3S[C@@]12C(=O)OCC)N4CCCC4	20000	nM	16527484
CHEMBL154000	NC(=O)c1cc2c3ccccc3[nH]c2c(n1)c4ccc5C(=O)C=C(NC=O)C(=O)c5n4	20500	nM	14667230
CHEMBL315784	OC(=O)c1ccccc1NC(=O)CCCCC(=O)Nc2ccccc2C(=O)O	21000	nM	9873592
CHEMBL88458	OC(=O)c1cc(Br)ccc1NC(=O)Cc2cccc(c2)C(=O)Nc3ccc(Br)cc3C(=O)O	21000	nM	9873592
CHEMBL2112098	CN1N=C(N)c2cn([C@H]3CC[C@@H](CO)O3)c4ncnc1c24	21000	nM	10882371
CHEMBL54793	Nc1cccc(Sc2ccccc2Br)c1C#N	21000	nM	11384233
CHEMBL56178	Nc1cccc([S+]([O-])c2ccc(Br)cc2)c1C#N	21000	nM	11384233
CHEMBL300934	Cc1ccc(cc1)[S+]([O-])c2cccc(N)c2C#N	21000	nM	11384233
CHEMBL293298	Cc1ccccc1[S+]([O-])c2cccc(N)c2C#N	21000	nM	11384233
CHEMBL312014	CC(C)CCCC(C)C1CCC2C3CC=C4CC(CC[C@]4(C)C3CC[C@]12C)OC(=O)Nc5cc(cc6cc(cc(O)c56)S(=O)(=O)O)S(=O)(=O)O	21800	nM	7520080
CHEMBL123839	Cc1nc(CCCCCOC(=O)C2CCCC2)n3nc(Cl)ccc13	22000	nM	7504733
CHEMBL292644	Nc1cccc([S+]([O-])c2cccc(c2)C(F)(F)F)c1C#N	22000	nM	11384233
CHEMBL408333	CC(C)[C@H](N)C(=O)N1CCC[C@@H]1C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C	22000	nM	16913724
CHEMBL197138	COc1c(C(=O)CC(C)C)c(O)c(CC=C(C)C)c2OC(=O)C=C(c3ccccc3)c12	22200	nM	16137881
CHEMBL340255	CCc1cc(NCc2c[nH]c3ccccc23)c(O)nc1C	22500	nM	1279173
CHEMBL33311	CCC(C)Sc1nc(O)c(C)c(Cc2cccc3ccccc23)n1	22500	nM	9154967
CHEMBL314443	O=C1N2CCSC2(c3ccccn3)c4ncccc14	23000	nM	7689109
CHEMBL52458	Nc1cccc(Sc2cccc(N)c2C#N)c1	23000	nM	11384233
CHEMBL55758	Nc1cccc([S+]([O-])c2ccc(cc2)C#N)c1C#N	23000	nM	11384233
CHEMBL188448	OC(=O)c1nc(nc(O)c1O)c2ccc(Cl)cc2	23000	nM	15481971
CHEMBL425857	OC(=O)c1ccc(NC(=O)CCN2C(=S)S\C(=C/c3ccc4OCOc4c3)\C2=O)cc1O	23000	nM	15634005
CHEMBL315488	Clc1ccc2c(c1)C(=O)N3CCSC23c4ccccc4	24000	nM	7689109
CHEMBL666	OC(=O)P(=O)(O)O	24000	nM	15189038
CHEMBL107180	CCc1c(O)nc(SCC(=O)c2ccc(F)cc2)nc1Cc3cccc4ccccc34	24200	nM	15149669
CHEMBL123864	CCc1cc(NCc2oc3cccc(c3n2)[N+](=O)[O-])c(O)nc1C	24500	nM	1279173
CHEMBL299935	Fc1ccc2NS(=O)(=O)NC(C#CC3CC3)(c2c1F)C(F)(F)F	24667	nM	10673109
CHEMBL328235	C=CCC1(Oc2ccccc2n3cccc3C1=O)c4ccccc4	25000	nM	8709096
CHEMBL423477	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)C(F)(F)P(=O)(O)O)C=C3	25000	nM	11881997
CHEMBL24118	NC1=Nc2c(ncn2C3CC(OCP(=O)(O)OP(=O)(O)C(F)(F)P(=O)(O)O)C=C3)C(=O)N1	25000	nM	11881997
CHEMBL16326	OC(=O)C(=O)\C=C(/O)\c1ccccc1	25000	nM	15481994
CHEMBL426588	OC(=O)c1ccc(NC(=O)CCCN2C(=S)S\C(=C/c3cccs3)\C2=O)cc1O	25000	nM	15634005
CHEMBL207997	COC(=O)C1=C([C@@H]2c3ccccc3S[C@]12C(=O)OC)N4CCC[C@@H]4C	25000	nM	16527484
CHEMBL305070	CC1CN(CC=C(C)C)C(C)c2cccc3nc(S)n1c23	25800	nM	8667357
CHEMBL85270	O=C1N2CCSC2(c3ccccc3)c4c1ccc5ccccc45	26000	nM	7689109
CHEMBL304269	COC(=O)c1cc(cc(Br)c1OC)C(=CC)c2cc(Br)c(OC)c(c2)C(=O)OC	26000	nM	9622549
CHEMBL2096838	COC(=O)CCC\C=C(/c1cccc(c1)C#N)\c2cc(C)c3OC(=O)N(C)c3c2	26400	nM	16913721
CHEMBL125196	CCc1cc(CN2C(=O)c3ccccc3C2=O)c(O)nc1C	26500	nM	1279172
CHEMBL305503	CCN1c2ccc(cc2N(C)C(=O)c3cccnc13)C(=O)N	27000	nM	1712395
CHEMBL34010	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(NC(=O)C(F)(F)F)ccc4[nH]3	27000	nM	7684450
CHEMBL175960	Oc1ccccc1C(=O)NN2C(=S)S\C(=C/c3ccc(Br)cc3)\C2=O	27000	nM	15634005
CHEMBL82443	CCCCCCCCCCCCCCCC(=O)Nc1ccc(c2cccc(c12)S(=O)(=O)O)S(=O)(=O)O	27500	nM	7520080
CHEMBL83300	CCc1cc(NCc2ccccc2N)c(O)nc1C	28000	nM	7678654
CHEMBL313308	O=C1N2CCSC2(c3cccnc3)c4ccccc14	28000	nM	7689109
CHEMBL378646	CC(C)[C@H](N)C(=O)N1C[C@@H](C[C@H]1C(=O)NCCCN2C(=O)N(C=C(C)C2=O)C3OC(CO[Si](C)(C)C(C)(C)C)C4(OS(=O)(=O)C=C4N)C3O[Si](C)(C)C(C)(C)C)OCc5ccccc5	28000	nM	16913724
CHEMBL338129	CCc1cc(NCc2occc2)c(O)nc1C	29000	nM	1279173
CHEMBL58811	C[C@H]1Cn2c(S)nc3ccc(C#C)c(CN1CC=C(C)C)c23	29500	nM	9857095
CHEMBL287025	CCC(C)Sc1nc(O)c(C)c(Cc2ccc3ccccc3c2)n1	29700	nM	9154967
CHEMBL106414	CCCOC(=O)CCCC=C(c1cc(C)c(OC)c(c1)C(=O)OC)c2cc(C)c(OC)c(c2)C(=O)OC	29700	nM	11708913
CHEMBL132692	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@@H](O)[C@H]1C)c5ccccc5	30000	nM	7506311
CHEMBL86039	O=C1N2CCSC2(c3ccncc3)c4ccccc14	30000	nM	7689109
CHEMBL84431	COc1ccc(cc1)C23SCCN2C(=O)c4ccccc34	30000	nM	7689109
CHEMBL3143797	COC(=O)\C=C\CN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	30000	nM	16220981
CHEMBL206629	COC(=O)C1=C(C2c3ccccc3SC12C(=O)OC)N4CCCC4	30000	nM	16527484
CHEMBL35434	C[C@H]1C(Cl)n2c(S)nc3cccc(CN1CC=C(C)C)c23	31000	nM	9873380
CHEMBL333862	C[S+]([O-])c1cc(NCc2oc3ccccc3n2)c(O)nc1C	31500	nM	1279173
CHEMBL65776	COC(=O)c1cc(cc(Br)c1OC)C(=CCCO)c2cc(Br)c(OC)c(c2)C(=O)OC	31600	nM	9622549
CHEMBL144509	CCC1(CCC\C=C(\c2cc(Cl)c(OC)c(CO)c2)/c3cc(Cl)c(OC)c(C=O)c3)OCCO1	31600	nM	10579849
CHEMBL383592	CC(C)C(=O)c1c(O)c(CC=C(C)C)c(O)c2C(=CC(=O)Oc12)c3ccccc3	31900	nM	16137881
CHEMBL2111874	Nc1ncnc2c1c(C#N)c(Br)n2[C@H]3O[C@H](CO)[C@@H](O)[C@@H]3F	32000	nM	7562946
CHEMBL25100	[O-][N+](=O)c1cccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)c1	32000	nM	9548815
CHEMBL368510	OC(=O)c1cc(NCc2cccc(c2)C#Cc3ccccc3)ccc1O	32000	nM	15634005
CHEMBL68175	CC1CN(CC(=C)C)Cc2cccc3NC(=O)N1c23	32100	nM	8667357
CHEMBL198546	CC(C)C(=O)c1c(O)c2C(=CC(=O)Oc2c3C=CC(C)(C)Oc13)c4ccccc4	32100	nM	16137881
CHEMBL123735	CCc1cc(NCc2oc3ccncc3c2)c(O)nc1C	32359.37	nM	8831772
CHEMBL32690	Oc1cc(Cc2ccc3ccccc3c2)nc(SC4CCCCC4)n1	33100	nM	9154967
CHEMBL433931	COc1ccc2NC(=S)N3C[C@H](C)N(CC=C(C)C)Cc1c23	33900	nM	9857095
CHEMBL287924	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4cc(C)ccc4[nH]3	34000	nM	7684450
CHEMBL65801	CC1CN2C(=O)Nc3cccc(CN1CC(=C)C)c23	34700	nM	8667357
CHEMBL89319	OC(=O)c1cc(Br)ccc1NC(=O)c2ccc(nc2)C(=O)Nc3ccc(Br)cc3C(=O)O	35000	nM	9873592
CHEMBL179642	OC(=O)c1cc(NC(=O)CCCN2C(=S)S\C(=C\c3cccs3)\C2=O)ccc1O	35000	nM	15634005
CHEMBL314003	CCc1cc(NCc2ccccc2COC)c(O)nc1C	35500	nM	7678654
CHEMBL58552	Clc1ccc2NS(=O)(=O)NC(C#CC3CC3)(C4CC4)c2c1	35870	nM	10673109
CHEMBL360014	C\C(=C/c1ccccc1)\C=C\2/SC(=S)N(CCC(=O)Nc3ccc(O)c(c3)C(=O)O)C2=O	36000	nM	15634005
CHEMBL96321	Oc1ccc2CC(COc2c1)OC(=O)c3ccc(O)c(O)c3O	36290	nM	11591519
CHEMBL37994	CC(C)Nc1cccnc1N2CCN(CC2)C(=O)c3cc4ccc(OCc5ccccc5)cc4[nH]3	37000	nM	7684450
CHEMBL96112	Oc1cc(O)c2CC(COc2c1)OC(=O)c3cccc(O)c3O	37240	nM	11591519
CHEMBL86243	C[C@@H]1CN2C(=O)c3ccccc3C2(O1)c4ccccc4	37600	nM	7689109
CHEMBL177375	OC(=O)c1cc(NC(=O)CCN2C(=S)S\C(=C/c3cccs3)\C2=O)ccc1O	38000	nM	15634005
CHEMBL424771	CCOc1cc(\C=C\2/SC(=S)N(NC(=O)c3ccccc3O)C2=O)ccc1O	38000	nM	15634005
CHEMBL378891	COC[C@H]1CCCN1C2=C(C(=O)OC)[C@@]3(Sc4ccccc4[C@H]23)C(=O)OC	38000	nM	16527484
CHEMBL310070	O=C1N2CCS[C@@]2(c3ccccc3)c4ccccc14	39600	nM	7689109
CHEMBL84699	C[C@@H]1COC2(N1C(=O)c3ccccc23)c4ccccc4	40000	nM	7689109
CHEMBL85459	O=C1N2Cc3ccccc3SC2(c4ccccc4)c5ccccc15	40000	nM	7689109
CHEMBL175828	OC(=O)c1cc(ccc1O)c2oc(C=C3C(=O)c4ccccc4C3=O)cc2	40000	nM	15634005
CHEMBL379329	COC(=O)C1=C([C@@H]2c3ccccc3S[C@]12C(=O)OC)N4CCCCC4	40000	nM	16527484
CHEMBL3144277	Nc1ncnc2c1ncn2[C@H]3C[C@H](OP(=O)(O)OC[C@H]4OC[C@H]([C@@H]4O)n5cnc6c(N)ncnc56)[C@@H](COP(=O)(O)O)O3	41000	nM	15341930
CHEMBL174899	Cc1nc(O)c(CCc2oc3ccccc3n2)cc1C(=O)N	41500	nM	7683054
CHEMBL346225	Cc1ccc(nc1)N2C(SCC2=O)c3c(C)cccc3Cl	42400	nM	12431069
CHEMBL321980	CC(C)c1c(O)nc(SCC(=O)C)nc1Cc2cccc3ccccc23	43100	nM	15149669
CHEMBL180113	Cc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3ccc(cc3)S(=O)(=O)Nc4nccs4)C2=O)cc1	44000	nM	15634005
CHEMBL126205	CCc1cc(NCCN2C(=O)c3ccccc3C2=O)c(O)nc1C	45000	nM	1279172
CHEMBL367515	CCc1cc(Cc2oc3ccccc3n2)c(O)nc1C	45000	nM	7683054
CHEMBL286313	Cc1c(O)nc(SC2CCCC2)nc1Cc3cccc4ccccc34	45000	nM	9154967
CHEMBL93130	Oc1ccc(C(=O)OC2COc3cccc(O)c3C2)c(O)c1O	45500	nM	11591519
CHEMBL334861	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@H]([C@H]1C)C(=O)c5ccc(Br)cc5)c6ccccc6	46000	nM	7506311
CHEMBL105018	CC1=CN(C2OC(CO[Si](C)(C)C(C)(C)C)CC2O[Si](C)(C)C(C)(C)C)C(=O)N(CC(=O)O)C1=O	47400	nM	11714616
CHEMBL311950	CCCCCCCCCCCCCCCC(=O)Nc1c(O)cc(c2ccccc12)S(=O)(=O)O	47600	nM	7520080
CHEMBL144096	Nc1ccc2c(cc(c(N)c2c1O)S(=O)(=O)O)S(=O)(=O)O	48000	nM	1282569
CHEMBL210099	COC[C@H]1CCCN1C2=C(C(=O)OC)C3(Sc4ccccc4C23)C(=O)OC	48000	nM	16527484
CHEMBL304317	CCCC1CN(CC(=C)C)Cc2cccc3NC(=O)N1c23	48100	nM	8667357
CHEMBL36019	Oc1cc(Cc2cccc3ccccc23)nc(SC4CCCC4)n1	48700	nM	9154967
CHEMBL214489	COC(=O)CCC\C=C(/c1cc(C)c2OC(=O)N(C)c2c1)\c3cc(C)c4ON(C)C(=O)c4c3	49200	nM	16913721
CHEMBL212395	COC(=O)CCC\C=C(\c1cccc(c1)C#N)/c2cc(C)c3ON(C)C(=O)c3c2	49600	nM	16913721
CHEMBL444789	Nc1cc(c2ccccc2c1N)S(=O)(=O)O	50000	nM	1282569
CHEMBL353328	CCc1cc(CCc2ccccc2)c(O)nc1C	50000	nM	7683054
CHEMBL132122	COc1ccc2N=C(S)C(CSC)N(C(=O)OC(C)C)c2c1	50000	nM	10514285
CHEMBL174719	OC(=O)C(=O)\C=C(/O)\c1cccc(OCc2cc(Cl)cc(Cl)c2C#N)c1	50000	nM	14695815
CHEMBL366202	Oc1nc2ccc(Cl)cc2n1CC3CCCCC3	50000	nM	15857150
CHEMBL439331	COC(=O)C1=C(C2c3ccccc3SC12C(=O)OC)N(C)C	50000	nM	16527484
CHEMBL208061	COC[C@H]1CCCN1C2=C(C(=O)OC)[C@]3(Sc4ccccc4[C@@H]23)C(=O)OC	50000	nM	16527484
CHEMBL302788	CCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2	50200	nM	7540209
CHEMBL2368778	COC[C@H]1O[C@H]([C@H](OC)[C@@H]1OP(=O)(C)O)n2cnc3C(=O)N(CC=C)C=Nc23	50500	nM	12723951
CHEMBL316043	O=C1N2CCCOC2(c3ccccc3)c4ccccc14	51000	nM	7689109
CHEMBL125030	CCc1cc(\C=C\N2C(=O)c3ccccc3C2=O)c(O)nc1C	54000	nM	1279172
CHEMBL19332	OC(=O)C(=O)CC(=O)c1ccccc1	54000	nM	14695815
CHEMBL1744147	[Na+].[Na+].[Na+].CCCCCCCCCCCCCCCC(=O)Nc1cc(cc2cc(cc(c12)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	55000	nM	1282569
CHEMBL194649	COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)\c2cc(F)cc(c2)C(F)(F)F	55300	nM	16162014
CHEMBL58506	C[C@H]1Cn2c(S)nc3ccc(C#N)c(CN1CC=C(C)C)c23	56300	nM	9857095
CHEMBL357261	Clc1cccc(Cl)c1C2SCC(=O)N2c3ccc(Br)cn3	56600	nM	12431069
CHEMBL304331	CC1C(C)n2c(O)nc3cccc(CN1CC=C(C)C)c23	56700	nM	8667357
CHEMBL312872	NC(=O)[C@H]1CSC2(N1C(=O)c3ccccc23)c4ccccc4	59000	nM	7689109
CHEMBL176380	OC(=O)c1ccc(NC(=O)CN2C(=S)S\C(=C/3\SC(=S)N(CC(=O)Nc4ccc(cc4)C(=O)O)C3=O)\C2=O)cc1	59000	nM	15634005
CHEMBL66377	CCCN1Cc2cccc3NC(=O)N(CC1C)c23	59700	nM	8667357
CHEMBL191692	Oc1nc2cc(Cl)ccc2n1Cc3c(F)cccc3F	60000	nM	15857150
CHEMBL323276	COC(=O)c1cc(cc(C)c1OC)C(=CCCCC(=O)OC(C)C)c2cc(C)c(OC)c(c2)C(=O)OC	60400	nM	11708913
CHEMBL357713	Fc1cccc(F)c1C2SCC(=O)N2c3ccc(Br)cn3	61400	nM	12431069
CHEMBL63394	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCN)c2cc(Cl)c(OC)c(c2)C(=O)OC	63000	nM	9622549
CHEMBL151175	Oc1cc(cc(O)c1O)C(=O)OC2COc3cccc(O)c3C2	64700	nM	11844664
CHEMBL133842	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCNC(=O)OCC(C)C)c2cc(Cl)c(OC)c(c2)C(=O)OC	65400	nM	11708913
CHEMBL282937	Cc1cccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)c1	66000	nM	9548815
CHEMBL175482	OC(=O)c1ccc(cc1)S(=O)(=O)c2ccc3C(=O)N(C(=O)c3c2)c4ccc(O)c(c4)C(=O)O	66000	nM	15634005
CHEMBL339425	CCc1cc(NCc2oc3cccc(N)c3n2)c(O)nc1C	67000	nM	1279173
CHEMBL150149	Fc1cccc(F)c1C2SCC(=O)N2c3ccc(Cl)cn3	67000	nM	12431069
CHEMBL368526	Oc1ccc(NC(=O)CN2C(=S)S\C(=C/3\SC(=S)N(CC(=O)Nc4ccc(O)cc4)C3=O)\C2=O)cc1	69000	nM	15634005
CHEMBL335955	C[C@H]1Oc2c([C@@H](O)[C@H]1C)c3OC(=O)C=C(c4ccccc4)c3c5O[C@H]6[C@@H](c25)C6(C)C	70000	nM	7506311
CHEMBL144121	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCCCl)c2cc(Cl)c(OC)c(c2)C(=O)OC	70000	nM	10579849
CHEMBL323259	COC(=O)c1cc(cc(Br)c1OC)C(=CCCCC(=O)OC(C)C)c2cc(Br)c(OC)c(c2)C(=O)OC	70800	nM	11708913
CHEMBL151146	Oc1cc(cc(O)c1O)C(=O)OCCc2ccccc2	72900	nM	11844664
CHEMBL84743	C[C@H]1COC2(N1C(=O)c3ccccc23)c4ccccc4	73000	nM	7689109
CHEMBL366369	CC1=NC(=O)C(=C(C)N1c2ccc(O)c(c2)C(=O)O)c3ccccc3	73000	nM	15634005
CHEMBL85514	O=C1N2CCCCC2(c3ccccc3)c4ccccc14	75500	nM	7689109
CHEMBL177335	COc1cc(cc(\C=C\C(=O)O)c1OC)S(=O)(=O)Nc2ccc(C(=O)O)c(O)c2	78000	nM	15634005
CHEMBL367493	Cc1ccc(\C=C\2/SC(=S)N(CC(=O)Nc3cc(ccc3O)[N+](=O)[O-])C2=O)cc1	80000	nM	15634005
CHEMBL175984	NS(=O)(=O)c1ccc(NC(=O)CCN2C(=S)S\C(=C/c3ccc(F)cc3)\C2=O)cc1	84000	nM	15634005
CHEMBL176125	OC(=O)c1ccc(NC(=O)CCN2C(=S)S\C(=C\c3cccs3)\C2=O)cc1	86000	nM	15634005
CHEMBL112732	CC1=C([Se]c2ccccc2)N(COCCO)C(=O)NC1=O	90300	nM	1720175
CHEMBL414840	CCOc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3cccc(c3)C(=O)O)C2=O)cc1	93000	nM	15634005
CHEMBL418686	COC(=O)c1cc(cc(Br)c1OC)C(=CCCN=[N+]=[N-])c2cc(Br)c(OC)c(c2)C(=O)OC	94000	nM	9622549
CHEMBL63229	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCOS(=O)(=O)C)c2cc(Cl)c(OC)c(c2)C(=O)OC	96000	nM	9622549
CHEMBL328142	Oc1ccc(C(=O)OC2COc3cc(O)cc(O)c3C2)c(O)c1	96300	nM	11591519
CHEMBL347272	Oc1cc(O)cc(c1)C(=O)OC2COc3cc(O)cc(O)c3C2	96300	nM	11844664
CHEMBL366397	COc1cc(\C=C/2\SC(=S)N(CCC(=O)Nc3ccc(cc3)C(=O)O)C2=O)cc(OC)c1OC	97000	nM	15634005
CHEMBL175563	O=C(CCN1C(=S)S\C(=C/c2ccc3OCOc3c2)\C1=O)Nc4ccc5OCOc5c4	97000	nM	15634005
CHEMBL196121	COc1ccc(cc1OC)\C(=C/CCN2CCOC2=O)\c3cc(F)cc(c3)C(F)(F)F	97800	nM	16162014
CHEMBL369600	Cc1ccc(\C=C/2\SC(=S)N(CC(=O)Nc3cccc(c3)C(=O)O)C2=O)cc1	98000	nM	15634005
CHEMBL179817	O=C(CCCC1C(=S)S\C(=C/c2cccs2)\C1=O)Nc3nc4ccccc4s3	98000	nM	15634005
CHEMBL108267	COC(=O)c1cc(cc(Br)c1OC)C(=CCCCC=C)c2cc(Br)c(OC)c(c2)C(=O)OC	99000	nM	11708913
CHEMBL368194	COc1ccccc1\C=C/2\SC(=S)N(CCC(=O)Nc3ccc(O)cc3)C2=O	99000	nM	15634005
CHEMBL113581	CC1=C([Se]c2ccccc2)N(COCCO)C(=S)NC1=O	100000	nM	1720175
CHEMBL334044	OCCOCN1C(=O)NC(=O)C(=C1[Se]c2ccccc2)Br	100000	nM	1720175
CHEMBL323914	OCCOCN1C(=O)NC(=O)C(=C1[Se]c2ccccc2)F	100000	nM	1720175
CHEMBL112227	OCCOCN1C(=O)NC(=O)C(=C1[Se]c2ccccc2)Cl	100000	nM	1720175
CHEMBL333863	Cc1nc(CCCCCO)n2nc(Cl)ccc12	100000	nM	7504733
CHEMBL132827	C[C@H]1Oc2c3C=CC(C)(C)Oc3c(\C(=C/C(=O)O)\c4ccccc4)c(O)c2C(=O)[C@@H]1C	100000	nM	7506311
CHEMBL336955	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2C(=O)[C@H]1C)c5ccccc5	100000	nM	7506311
CHEMBL129992	C[C@H]1Oc2c([C@@H](O)[C@H]1C)c3OC(=O)C=C(c4ccccc4)c3c5O[C@@H]6[C@H](c25)C6(C)C	100000	nM	7506311
CHEMBL134236	C[C@H]1Oc2c3C=CC(C)(C)Oc3c(\C(=C/C(=O)O)\c4ccccc4)c(O)c2C(=O)[C@H]1C	100000	nM	7506311
CHEMBL132986	C[C@H]1Oc2c3C=CC(C)(C)Oc3c4C(=CC(=O)Oc4c2[C@H](OC(=O)C)[C@@H]1C)c5ccccc5	100000	nM	7506311
CHEMBL133575	COc1c2C=CC(C)(C)Oc2c(\C(=C\C(=O)O)\c3ccccc3)c(O)c1C(=O)\C(=C\C)\C	100000	nM	7506311
CHEMBL68530	CC(=O)OCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2=O	100000	nM	7540209
CHEMBL69934	OCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2	100000	nM	7540209
CHEMBL69275	CN1C(=O)N(COCCOC(=O)C)C2=C(CNc3ccccc3S2)C1=O	100000	nM	7540209
CHEMBL303273	OCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2c4ccccc4	100000	nM	7540209
CHEMBL66758	CC(=O)OCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2c4ccccc4	100000	nM	7540209
CHEMBL303928	O=C1NC(=O)C2=C(N1)Sc3ccccc3NC2	100000	nM	7540209
CHEMBL66016	OCCOCN1C(=O)NC(=O)C2=C1Sc3ccccc3NC2c4ccc(cc4)[N+](=O)[O-]	100000	nM	7540209
CHEMBL2112691	Nc1ncnc2c1c(cn2[C@H]3O[C@H](CO)[C@@H](O)[C@@H]3F)C#N	100000	nM	7562946
CHEMBL367850	CCC1=C(C)NC(N)C(=C1)CCc2oc3ccccc3n2	100000	nM	7683054
CHEMBL85500	O=C1N2CCNC2(c3ccccc3)c4ccccc14	100000	nM	7689109
CHEMBL84430	O=C1N2CCSC2(c3ccc[nH]3)c4ccccc14	100000	nM	7689109
CHEMBL82629	O=C1N2CCSC2(c3ccccc3)c4ccc5ccccc5c14	100000	nM	7689109
CHEMBL85063	O=C1N2CCSC2(c3ccccc3)c4cccnc14	100000	nM	7689109
CHEMBL84693	OC(=O)[C@H]1CSC2(N1C(=O)c3ccccc23)c4ccccc4	100000	nM	7689109
CHEMBL315116	C[C@H]1CN2C(=O)c3ccccc3C2(O1)c4ccccc4	100000	nM	7689109
CHEMBL84595	O=C1N2CCSC2(c3ccccc3)c4ccncc14	100000	nM	7689109
CHEMBL32718	O=C1C(Sc2ccccc2n3cccc13)c4ccccc4	100000	nM	8709096
CHEMBL330735	CCC1Oc2ccccc2n3cccc3C1=O	100000	nM	8709096
CHEMBL34996	CCC(C)Sc1nc(O)c(C)c(COc2ccccc2)n1	100000	nM	9154967
CHEMBL282268	Clc1ccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)cc1Cl	100000	nM	9548815
CHEMBL276979	COc1ccc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)cc1	100000	nM	9548815
CHEMBL23032	Cc1ccc(Cn2c(Cl)nc3cc(Cl)c(Cl)cc23)cc1	100000	nM	9548815
CHEMBL280386	FC(F)(F)c1cc(Cn2c(Br)nc3cc(Cl)c(Cl)cc23)cc(c1)C(F)(F)F	100000	nM	9548815
CHEMBL279744	[O-][N+](=O)c1ccc(Cn2c(Cl)nc3cc(Cl)c(Cl)cc23)cc1	100000	nM	9548815
CHEMBL2092833	CC1=CN([C@@H]2C[C@@H](F)[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C(=O)NC1=O	100000	nM	9622545
CHEMBL483492	CC1=CN([C@@H]2C[C@@H](F)[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O2)C(=O)N=C1N	100000	nM	9622545
CHEMBL63988	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCC(=O)O)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	9622549
CHEMBL65019	COC(=O)c1cc(cc(Br)c1OC)C(=C)c2cc(Br)c(OC)c(c2)C(=O)OC	100000	nM	9622549
CHEMBL63505	CC1(C)OC(=O)c2cc(cc(Cl)c2O1)C(=CCCBr)c3cc(Cl)c4OC(C)(C)OC(=O)c4c3	100000	nM	9622549
CHEMBL67896	COC(=O)c1cc(cc(Cl)c1OC)C(=CC(=O)O)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	9622549
CHEMBL63872	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCO)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	9622549
CHEMBL63920	COC(=O)c1cc(cc(Cl)c1OC)C(=CC(=O)OC(C)(C)C)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	9622549
CHEMBL63567	CC1(C)OC(=O)c2cc(cc(Cl)c2O1)C(=CCCO)c3cc(Cl)c4OC(C)(C)OC(=O)c4c3	100000	nM	9622549
CHEMBL63900	COC=C(c1cc(Br)c(OC)c(c1)C(=O)OC)c2cc(Br)c(OC)c(c2)C(=O)OC	100000	nM	9622549
CHEMBL65753	COc1c(Cl)cc(cc1C(=O)O)C(=CCCCC(=O)O)c2cc(Cl)c(OC)c(c2)C(=O)O	100000	nM	9622549
CHEMBL63473	COc1c(Cl)cc(cc1C(=O)O)C(=CCC(=O)O)c2cc(Cl)c(OC)c(c2)C(=O)O	100000	nM	9622549
CHEMBL88610	CC(=O)Nc1ccc(NC(=O)CCCCC(=O)Nc2ccc(NC(=O)C)cc2C(=O)O)c(c1)C(=O)O	100000	nM	9873592
CHEMBL89841	OC(=O)c1cc(ccc1NC(=O)CCCCC(=O)Nc2ccc(cc2C(=O)O)C#N)C#N	100000	nM	9873592
CHEMBL329899	CC1(C)C2CC(C\N=C(/S)\Nc3ccc(Br)cn3)CC1C2	100000	nM	10509923
CHEMBL93237	Brc1ccc(NC(=S)NCC23CC4CC(CC(C4)C2)C3)nc1	100000	nM	10509923
CHEMBL359242	COC(=O)CCCCC(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	10579849
CHEMBL343149	COC(=O)CC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	10579849
CHEMBL142532	COC(=O)CCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	10579849
CHEMBL114652	Brc1ccc(NC(=S)NCCN2CCOCC2)nc1	100000	nM	10617082
CHEMBL117182	CN1CCCC1CC\N=C(/S)\Nc2ccc(Br)cn2	100000	nM	10617082
CHEMBL117524	Brc1ccc(NC(=S)NCCc2c[nH]cn2)nc1	100000	nM	10617082
CHEMBL171716	Fc1ccccc1CC\N=C(\Nc2ccc(Br)cn2)/SCc3ccccc3	100000	nM	10636251
CHEMBL170861	Clc1ccccc1CC\N=C(\Nc2ccc(Br)cn2)/SCc3ccccc3	100000	nM	10636251
CHEMBL171455	COc1ccc(OC)c(CC\N=C(\Nc2ccc(Br)cn2)/SCc3ccccc3)c1	100000	nM	10636251
CHEMBL170798	CS\C(=N/CCc1ccccc1Cl)\Nc2ccc(Br)cn2	100000	nM	10636251
CHEMBL609194	C[C@H]1OC([C@H](O)[C@@H]1O)n2cc3C(=NN(C)c4ncnc2c34)N	100000	nM	10882371
CHEMBL314567	CN1N=C(N)c2cn(C3C[C@@H](O)[C@@H](CO)O3)c4ncnc1c24	100000	nM	10882371
CHEMBL1790617	CN1N=C(N)c2cn([C@@H]3O[C@H](CO)C[C@H]3O)c4ncnc1c24	100000	nM	10882371
CHEMBL2367598	CN1N=C(N)c2cn([C@@H]3O[C@H](CO)C=C3)c4ncnc1c24	100000	nM	10882371
CHEMBL315509	CN1N=C(N)c2cn(C3O[C@H](CO)[C@H]4O[C@H]34)c5ncnc1c25	100000	nM	10882371
CHEMBL610370	CN1N=C(NC(=O)C(C)(C)C)c2cn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c4ncnc1c24	100000	nM	10882373
CHEMBL608900	CN1N=C(NC(=O)c2ccccc2)c3cn(C4O[C@H](CO)[C@@H](O)[C@H]4O)c5ncnc1c35	100000	nM	10882373
CHEMBL291886	C[C@H](\N=C(/S)\Nc1ccc(Cl)cn1)c2ccccc2	100000	nM	10999473
CHEMBL63222	C[C@H](\N=C(/S)\Nc1ccc(Br)cn1)C2CCCCC2	100000	nM	10999473
CHEMBL434213	C[C@H](\N=C(/S)\Nc1nccs1)C2CCCCC2	100000	nM	10999473
CHEMBL304914	C[C@H](\N=C(/S)\Nc1ccccn1)C2CCCCC2	100000	nM	10999473
CHEMBL305150	C[C@@H](\N=C(/S)\Nc1ccccn1)C2CCCCC2	100000	nM	10999473
CHEMBL345996	S=C(NCCOc1ccccc1)Nc2nccs2	100000	nM	11229762
CHEMBL149100	Cc1ccc(CC\N=C(/S)\Nc2nccs2)cc1	100000	nM	11229762
CHEMBL345289	S=C(NCCc1cccs1)Nc2nccs2	100000	nM	11229762
CHEMBL358280	S=C(NCCCn1ccnc1)Nc2nccs2	100000	nM	11229762
CHEMBL93249	Oc1ccc(C(=O)OC2COc3ccccc3C2)c(O)c1O	100000	nM	11591519
CHEMBL92678	Oc1cc(O)c2CC(COc2c1)OC(=O)c3ccccc3	100000	nM	11591519
CHEMBL92677	Oc1cccc(c1)C(=O)OC2COc3cc(O)cc(O)c3C2	100000	nM	11591519
CHEMBL288114	OC(=O)c1cc(O)c(O)c(O)c1	100000	nM	11591519
CHEMBL583912	O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c3ccc(O)c(O)c3	100000	nM	11591519
CHEMBL130934	COC(=O)c1cc(cc(C)c1OC)C(=CCCCC(=O)OCC[Si](C)(C)C)c2cc(C)c(OC)c(c2)C(=O)OC	100000	nM	11708913
CHEMBL133685	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCC(=O)OC(C)C)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	11708913
CHEMBL131699	CCNC(=O)NCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	11708913
CHEMBL131674	CN\C(=N\CCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC)\S	100000	nM	11708913
CHEMBL106554	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCc2ccccc2)c3cc(Cl)c(OC)c(c3)C(=O)OC	100000	nM	11708913
CHEMBL339176	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCNC(=O)C)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	11708913
CHEMBL130984	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCSC)c2cc(Cl)c(OC)c(c2)C(=O)OC	100000	nM	11708913
CHEMBL133395	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCC(=O)N2CCCCC2)c3cc(Cl)c(OC)c(c3)C(=O)OC	100000	nM	11708913
CHEMBL110175	COC(=O)c1cc(cc(Br)c1OC)C(=CCCCc2ccccc2)c3cc(Br)c(OC)c(c3)C(=O)OC	100000	nM	11708913
CHEMBL336737	COC(CCCC=C(c1cc(Cl)c(OC)c(c1)C(=O)OC)c2cc(Cl)c(OC)c(c2)C(=O)OC)OC	100000	nM	11708913
CHEMBL355912	Oc1cc(O)c2CC(COc2c1)OC(=O)c3ccc(O)c(O)c3	100000	nM	11844664
CHEMBL151791	COc1cc(OC)c2CC(COc2c1)OC(=O)c3cc(O)c(O)c(O)c3	100000	nM	11844664
CHEMBL152850	O=C1NNC(=O)c2ccccc2SSc3ccccc3C(=O)NNC(=O)c4ccccc4SSc5ccccc15	100000	nM	12477350
CHEMBL157373	Sc1ccccc1C(=O)NNC(=O)c2ccccc2SSc3ccccc3C(=O)NNC(=O)c4ccccc4S	100000	nM	12477350
CHEMBL157428	Sc1ccccc1C(=O)NNC(=O)c2ccccc2S	100000	nM	12477350
CHEMBL440562	OC(=O)c1nc(nc(O)c1O)c2ccccc2	100000	nM	15481971
CHEMBL364321	OC(=O)c1nc(nc(O)c1O)c2cccc(O)c2	100000	nM	15481971
CHEMBL188307	OC(=O)c1nc(nc(O)c1O)c2cccc(OCc3ccccc3)c2	100000	nM	15481971
CHEMBL177242	COc1cc(cc(OC)c1OC)C(=O)Nc2ccc(O)c(c2)C(=O)O	100000	nM	15634005
CHEMBL176129	[O-][N+](=O)c1ccc(NC(=O)CCN2C(=S)S\C(=C/c3ccccc3Cl)\C2=O)cc1	100000	nM	15634005
CHEMBL435309	O=C(CCN1C(=S)S\C(=C/c2cccs2)\C1=O)Nc3ccc4ccccc4c3	100000	nM	15634005
CHEMBL179161	Oc1cccc(NC(=O)CCN2C(=S)S\C(=C/c3cccs3)\C2=O)c1	100000	nM	15634005
CHEMBL176084	OCCNC1=C(\C=C\2/SC(=S)N(Cc3occc3)C2=O)C(=O)N4C=CC=CC4=N1	100000	nM	15634005
CHEMBL367503	Cc1onc(c2ccccc2Cl)c1C(=O)c3ccc(O)c(c3)C(=O)O	100000	nM	15634005
CHEMBL175837	Oc1cc(ccc1NC(=O)CN2C(=S)S\C(=C/c3ccccc3Cl)\C2=O)[N+](=O)[O-]	100000	nM	15634005
CHEMBL366814	COc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3cccc(O)c3)C2=O)cc1OC	100000	nM	15634005
CHEMBL179356	Cc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3cccc(c3)C(=O)O)C2=O)cc1	100000	nM	15634005
CHEMBL179221	COc1cccc(\C=C/2\SC(=S)N(CC(=O)Nc3ccc(cc3O)[N+](=O)[O-])C2=O)c1	100000	nM	15634005
CHEMBL361631	OC(=O)c1cc(NC(=S)NC(=O)c2ccccc2)ccc1O	100000	nM	15634005
CHEMBL367031	Cc1ccc(\C=C\2/SC(=S)N(CC(=O)Nc3ccc(cc3O)[N+](=O)[O-])C2=O)cc1	100000	nM	15634005
CHEMBL367845	Oc1ccc(\C=C\2/SC(=S)N(C2=O)c3ccccc3)c(O)c1	100000	nM	15634005
CHEMBL368303	CCOC(=O)N1CCN(CC1)C(=O)CCN2C(=S)S\C(=C/c3ccc(OC)c(OC)c3)\C2=O	100000	nM	15634005
CHEMBL175822	OC(=O)c1cccc(NC(=O)CCN2C(=S)S\C(=C/c3cccs3)\C2=O)c1	100000	nM	15634005
CHEMBL369513	COc1ccc(\C=C\2/SC(=S)N(CCC(=O)Nc3cccc(c3)C(=O)O)C2=O)cc1	100000	nM	15634005
CHEMBL175480	COc1cccc(\C=C/2\SC(=S)N(CC(=O)Nc3cccc(c3)C(=O)O)C2=O)c1	100000	nM	15634005
CHEMBL179045	OC(=O)c1cccc(NC(=O)CN2C(=S)S\C(=C/c3ccccc3Cl)\C2=O)c1	100000	nM	15634005
CHEMBL369010	CCc1ccc(\C=C/2\SC(=S)N(CC(=O)Nc3cccc(c3)C(=O)O)C2=O)cc1	100000	nM	15634005
CHEMBL179024	Cc1oc(cc1)C(=O)Nc2ccc(O)c(c2)C(=O)O	100000	nM	15634005
CHEMBL188293	Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4cccnc4)c(O)c3n2)cc1O	100000	nM	16002283
CHEMBL187452	Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4ccc(cc4)[N+](=O)[O-])c(O)c3n2)cc1O	100000	nM	16002283
CHEMBL189128	Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4ccccc4[N+](=O)[O-])c(O)c3n2)cc1O	100000	nM	16002283
CHEMBL188712	Oc1ccc(cc1)C(=O)c2ccc3ccc(\C=C\c4ccc(O)c(O)c4)nc3c2O	100000	nM	16002283
CHEMBL189715	Oc1ccc(\C=C\c2ccc3ccc(C(=O)c4ccc(F)c(F)c4)c(O)c3n2)cc1O	100000	nM	16002283
CHEMBL381449	COC(=O)CCC\C=C(\c1cc(C)c(OC)c(c1)C(=O)OC)/c2cc(F)cc(c2)C(F)(F)F	100000	nM	16162014
CHEMBL194615	COC(=O)CCC\C=C(\c1cc(Cl)c(OC)c(c1)C(=O)OC)/c2cc(Cl)ccc2OC	100000	nM	16162014
CHEMBL194957	COC(=O)CCC\C=C(/c1cc(C)c(OC)c(c1)C(=O)OC)\c2cc(Cl)ccc2OC	100000	nM	16162014
CHEMBL194617	COC(=O)CCC\C=C(\c1cc(C)c(OC)c(c1)C(=O)OC)/c2cc(Cl)ccc2OC	100000	nM	16162014
CHEMBL196275	COC(=O)CCC\C=C(/c1cc(F)cc(c1)C(F)(F)F)\c2cc(C)c3ON(C)C(=O)c3c2	100000	nM	16162014
CHEMBL196011	COC(=O)CCC\C=C(\c1cc(Cl)c(OC)c(c1)C(=O)OC)/c2cc(F)cc(c2)C(F)(F)F	100000	nM	16162014
CHEMBL196174	COc1ccc(cc1OC)\C(=C/CCN2CCOC2=O)\c3cc(F)ccc3C(F)(F)F	100000	nM	16162014
CHEMBL2096827	COC(=O)c1cc(cc(C)c1OC)\C(=C\CCN2CCOC2=O)\c3ccc(OC)c(OC)c3	100000	nM	16162014
CHEMBL380997	CCC[C@]1(CC(=O)O)OCCc2c1sc3c(C)cc(F)c(C#N)c23	100000	nM	16274990
CHEMBL210593	Cc1cc(c(N)cc1Cl)S(=O)(=O)N2CCC[C@H]2C(=O)O	100000	nM	16722622
CHEMBL123968	CCc1cc(NCc2oc3cnccc3c2)c(O)nc1C	104712.85	nM	8831772
CHEMBL125806	CC(=O)OCCCCCc1nc(C)c2ccc(Cl)nn12	110000	nM	7504733
CHEMBL434047	CC(C)c1nc(CCCCCCC(=O)c2ccccc2)n3nc(Cl)ccc13	110000	nM	7504733
CHEMBL85051	CCc1cc(NCc2ccncc2OC)c(O)nc1C	110000	nM	7678654
CHEMBL58581	Fc1cccc(F)c1Cn2c(nc3ccccc23)c4c(F)cccc4F	110000	nM	9435891
CHEMBL315855	OC(=O)c1cc(F)ccc1NC(=O)CCCCC(=O)Nc2ccc(F)cc2C(=O)O	120000	nM	9873592
CHEMBL89669	OC(=O)c1cc(O)ccc1NC(=O)CCCCC(=O)Nc2ccc(O)cc2C(=O)O	120000	nM	9873592
CHEMBL1788186	[Na+].[Na+].[Na+].[Na+].Oc1cc(cc2cc(cc(NC(=O)CCCCCCCCC(=O)Nc3cc(cc4cc(cc(O)c34)S(=O)(=O)[O-])S(=O)(=O)[O-])c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	122000	nM	1282569
CHEMBL195013	CC(C)CC(=O)c1c(O)c2C(=CC(=O)Oc2c3C=CC(C)(C)Oc13)c4ccccc4	123800	nM	16137881
CHEMBL425511	[Na+].[Na+].Oc1cc(cc2cc(cc(O)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	125000	nM	1282569
CHEMBL116291	OCCOCN1C(=O)NC(=O)C=C1[Se]c2ccccc2	139000	nM	1720175
CHEMBL125702	CCc1cc(NCc2cocc2)c(O)nc1C	145000	nM	1279173
CHEMBL88836	CCC1(Oc2cc3ccccc3cc2n4cccc4C1=O)c5ccccc5	150000	nM	8709096
CHEMBL1744156	[Na+].Nc1c(O)c2c(O)cc(cc2cc1S(=O)(=O)O)S(=O)(=O)[O-]	162000	nM	1282569
CHEMBL1744153	[Na+].[Na+].[Na+].Oc1cc(cc2cc(cc(NC(=O)CCCCCCCCC(=O)[O-])c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	170000	nM	1282569
CHEMBL320056	CCOC(=O)CSc1nc(O)c(C(C)C)c(Cc2cccc3ccccc23)n1	175000	nM	15149669
CHEMBL440706	CCc1c(O)nc(SCC(=O)c2ccc(OC)cc2)nc1Cc3cccc4ccccc34	178000	nM	15149669
CHEMBL324237	CC(C)c1c(O)nc(SCC(=O)c2ccc(F)cc2)nc1Cc3cccc4ccccc34	188000	nM	15149669
CHEMBL124492	CCc1cc(NCCCN2C(=O)c3ccccc3C2=O)c(O)nc1C	190000	nM	1279172
CHEMBL293961	Cc1cccc2c1nc(c3c(F)cccc3F)n2Cc4c(F)cccc4F	200000	nM	9435891
CHEMBL607677	CC1=CN(C2O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)C(=O)NC1=O	200000	nM	9622545
CHEMBL130041	COC(=O)CCCC=C(c1cc(C(=O)OC)c(OC)c(c1)C(F)(F)F)c2cc(C(=O)OC)c(OC)c(c2)C(F)(F)F	200000	nM	11708913
CHEMBL23333	NC1=Nc2c(ncn2C3CC(OCP(=O)(O)OP(=O)(O)C(Br)(Br)P(=O)(O)O)C=C3)C(=O)N1	200000	nM	11881997
CHEMBL24006	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)C(Br)(Br)P(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(N)ncnc56)C=C3	200000	nM	11881997
CHEMBL3142817	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C(=O)N(CC(=O)O)C1=O	207000	nM	11714616
CHEMBL340092	CCc1cc(CCCN2C(=O)c3ccccc3C2=O)c(O)nc1C	210000	nM	1279172
CHEMBL1744155	[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c1cc(NC(=O)CCCCCCCCCCC(=O)Nc2cc(cc3cc(cc(c23)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])c4c(cc(cc4c1)S(=O)(=O)[O-])S(=O)(=O)[O-]	214000	nM	1282569
CHEMBL85517	OS(=O)(=O)c1ccc2c(OS(=O)(=O)c3cccc4c(cccc34)S(=O)(=O)Oc5cc(cc6cc(ccc56)S(=O)(=O)O)S(=O)(=O)O)cc(cc2c1)S(=O)(=O)O	215000	nM	7520080
CHEMBL108360	CC(C)c1c(O)nc(SCC(=O)c2ccc(C)cc2)nc1Cc3cccc4ccccc34	225000	nM	15149669
CHEMBL1788137	[Na+].CC(=O)Nc1cc(cc2cc(cc(O)c12)S(=O)(=O)[O-])S(=O)(=O)O	243000	nM	1282569
CHEMBL23522	Nc1nc(O)c2ncn(C3CC(OCP(=O)(O)OP(=O)(O)C(Br)(Br)P(=O)(O)OP(=O)(O)COC4CC(C=C4)n5cnc6c(O)nc(N)nc56)C=C3)c2n1	250000	nM	11881997
CHEMBL3143761	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC(=O)OCc4ccccc4)C1=O	250000	nM	16220981
CHEMBL110224	COC(=O)c1cc(cc(Cl)c1OC)C(=CCCCC=C)c2cc(Cl)c(OC)c(c2)C(=O)OC	258000	nM	11708913
CHEMBL439655	CCc1cc(CCc2ccccn2)c(O)nc1C	260000	nM	7683054
CHEMBL3142914	CCOC(=O)P(=O)(O)OCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	293000	nM	15189038
CHEMBL108196	COC(=O)CSc1nc(O)c(C)c(Cc2cccc3ccccc23)n1	296000	nM	15149669
CHEMBL125836	CCc1cc(C(O)CN2C(=O)c3ccccc3C2=O)c(O)nc1C	300000	nM	1279172
CHEMBL421626	CCc1cc(C(=O)CN2C(=O)c3ccccc3C2=O)c(O)nc1C	300000	nM	1279172
CHEMBL124910	CCC1=C(C)NC(OC)C(=C1)C(O)CN2C(=O)c3ccccc3C2=O	300000	nM	1279172
CHEMBL125930	Oc1ncccc1CCN2C(=O)c3ccccc3C2=O	300000	nM	1279172
CHEMBL124603	CCC1=C(C)NC(OC)C(=C1)CCCN2C(=O)c3ccccc3C2=O	300000	nM	1279172
CHEMBL338185	CCC1=C(C)NC(OC)C(=C1)C(=O)CN2C(=O)c3ccccc3C2=O	300000	nM	1279172
CHEMBL123729	Oc1nc2ccccc2cc1NCc3ccc4ccccc4c3	300000	nM	1279173
CHEMBL173280	CCc1cc(NCC(=O)Nc2c(O)cc(Cl)cc2Cl)c(O)nc1C	300000	nM	7683054
CHEMBL173868	CCc1cc(CCC(=O)Nc2c(O)cc(Cl)cc2Cl)c(O)nc1C	300000	nM	7683054
CHEMBL327869	O=C1C(Oc2ccccc2n3cccc13)c4ccccc4	300000	nM	8709096
CHEMBL314882	O=C1C(Oc2cc3ccccc3cc2n4cccc14)c5ccccc5	300000	nM	8709096
CHEMBL88838	CCC1(C(=O)c2cccn2c3ccccc3S1(=O)=O)c4ccccc4	300000	nM	8709096
CHEMBL94074	O=C1C(Oc2ccccc2n3cccc13)c4ccc5ccccc5c4	300000	nM	8709096
CHEMBL85975	CCc1cc(NCc2cccnc2)c(O)nc1C	301995.17	nM	8831772
CHEMBL3142919	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCOP(=O)(O)C(=O)OCc4ccccc4)C1=O	312000	nM	15189038
CHEMBL3350582	[Na+].CC1CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COCP(=O)(O)OP(=O)(O)OP(=O)(O)[O-])O2)C(=O)NC1=O	322000	nM	1697345
CHEMBL3143794	COC(=O)CCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	327000	nM	16220981
CHEMBL1788183	[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c1cc(c2cc(NS(=O)(=O)c3ccc(cc3)c4ccc(cc4)S(=O)(=O)Nc5ccc6cc(cc(c6c5)S(=O)(=O)[O-])S(=O)(=O)[O-])ccc2c1)S(=O)(=O)[O-]	374000	nM	1282569
CHEMBL1744433	[Na+].[Na+].[Na+].[Na+].Oc1c(cc(NS(=O)(=O)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)Nc4cc(C(=O)[O-])c(O)c(c4)S(=O)(=O)[O-])cc1S(=O)(=O)[O-])C(=O)[O-]	427000	nM	1282569
CHEMBL3142918	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCOP(=O)(O)C(=O)O)C1=O	437000	nM	15189038
CHEMBL298626	C[C@H]1Cn2c(O)nc3ccc(C#C)c(CN1CC=C(C)C)c23	437100	nM	9857095
CHEMBL84783	CC1=C(Sc2ccccc2)N(COCCOP(=O)(O)P(=O)(O)P(=O)(O)O)C(=O)NC1=O	500000	nM	2479745
CHEMBL31871	CC1=C(Sc2ccccc2)N(COCCO)C(=O)NC1=O	500000	nM	2479745
CHEMBL91491	CCCC1(Oc2ccccc2n3cccc3C1=O)c4ccccc4	500000	nM	8709096
CHEMBL330479	CC(=CCC1(Oc2ccccc2n3cccc3C1=O)c4ccccc4)C	500000	nM	8709096
CHEMBL92308	O=C1c2cccn2c3ccccc3OC1(CC4CC4)c5ccccc5	500000	nM	8709096
CHEMBL92330	CCC1([S+]([O-])c2ccccc2n3cccc3C1=O)c4ccccc4	500000	nM	8709096
CHEMBL330036	CCC1(Sc2c(Cl)cccc2n3cccc3C1=O)c4ccccc4	500000	nM	8709096
CHEMBL279468	CC1=CN(C2OC(CNC(=O)CC3(C)CC(O)CN3C(=O)OC(C)(C)C)C=C2)C(=O)NC1=O	500000	nM	9871737
CHEMBL20371	CC1=CN(C2OC(CNC(=O)CC3(C)CC(O)CN3)C=C2)C(=O)NC1=O	500000	nM	9871737
CHEMBL20165	CC1=CN(C2CC(O)C(CNC(=O)CC3(C)CC(O)CN3)O2)C(=O)NC1=O	500000	nM	9871737
CHEMBL19871	CC1=CN(C2OC(CNC(=O)CC3(C)CC(CN3C(=O)OC(C)(C)C)O[Si](c4ccccc4)(c5ccccc5)C(C)(C)C)C=C2)C(=O)NC1=O	500000	nM	9871737
CHEMBL429390	CC1=CN(C2CC(O[Si](C)(C)C(C)(C)C)C(CNC(=O)CC3(C)CC(CN3C(=O)OC(C)(C)C)O[Si](c4ccccc4)(c5ccccc5)C(C)(C)C)O2)C(=O)NC1=O	500000	nM	9871737
CHEMBL3142920	COC(=O)P(=O)(OC)OCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	500000	nM	15189038
CHEMBL3143801	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCNC(=O)OCc4ccccc4)C1=O	500000	nM	16220981
CHEMBL3143791	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCc4cccc5cc[nH]c45)C1=O	500000	nM	16220981
CHEMBL3143800	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCCN4C(=O)c5ccccc5C4=O)C1=O	500000	nM	16220981
CHEMBL3143802	CCCCOC(=O)CN(CCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)CC(=O)OCCCC	500000	nM	16220981
CHEMBL3143762	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(Cc4ccccc4)C1=O	500000	nM	16220981
CHEMBL3143765	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CCBr)C1=O	500000	nM	16220981
CHEMBL3143766	CC1=CN([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)C(=O)N(CC4CC4)C1=O	500000	nM	16220981
CHEMBL3143795	CCOC(=O)CCCCCN1C(=O)N(C=C(C)C1=O)[C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C	500000	nM	16220981
CHEMBL316357	CCC1(Sc2cccc(Cl)c2n3cccc3C1=O)c4ccccc4	600000	nM	8709096
CHEMBL90736	CCC1(Sc2ccc(C)cc2n3cccc3C1=O)c4ccccc4	600000	nM	8709096
CHEMBL1788136	[Na+].[Na+].Oc1cc(cc2cc(cc(NC(=O)c3ccccc3)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	721000	nM	1282569
CHEMBL1744145	[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c1cc(NS(=O)(=O)c2ccc(cc2)c3ccc(cc3)S(=O)(=O)Nc4cc(cc5cc(cc(c45)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])c6c(cc(cc6c1)S(=O)(=O)[O-])S(=O)(=O)[O-]	849000	nM	1282569
CHEMBL58493	C[C@H]1Cn2c(O)nc3ccc(C)c(CN1CC=C(C)C)c23	989000	nM	9857095
CHEMBL1744158	[Na+].[Na+].CC(=O)Oc1cc(cc2cc(cc(OC(=O)C)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744148	[Na+].[Na+].[Na+].CC(=O)Nc1cc(cc2cc(cc(c12)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744146	[Na+].[Na+].[Na+].[Na+].[O-]S(=O)(=O)c1ccc(cc1)c2ccc(cc2)S(=O)(=O)Nc3cc(cc4cc(cc(c34)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744159	[Na+].CC(=O)Oc1cc(cc2cc(c(N=Nc3ccccc3)c(OC(=O)C)c12)S(=O)(=O)O)S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744149	[Na+].[Na+].CC(=O)Nc1cc(cc2cc(cc(OC(=O)C)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1788176	[Na+].[Na+].Nc1ccc2cc(cc(c2c1)S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744151	[Na+].COc1cc(cc2cc(cc(c12)[N+](C)(C)C)S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1788189	[Na+].Nc1cc(cc2cc(cc(O)c12)S(=O)(=O)[O-])S(=O)(=O)O	1000000	nM	1282569
CHEMBL1744150	[Na+].[Na+].OC(=O)CCCC(=O)Nc1cc(cc2cc(cc(O)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744154	[Na+].[Na+].[Na+].Nc1cc(cc2cc(cc(c12)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL1744152	[Na+].[Na+].COc1cc(cc2cc(cc(N(C)C)c12)S(=O)(=O)[O-])S(=O)(=O)[O-]	1000000	nM	1282569
CHEMBL423652	Nc1ncnc2c1ncn2C3CC(OCP(=O)(O)OP(=O)(O)C(Br)(Br)P(=O)(O)O)C=C3	1000000	nM	11881997
CHEMBL3144276	NC1=NC(=O)N(C=C1)[C@@H]2CO[C@H](COP(=O)(O)O[C@H]3C[C@@H](O[C@@H]3COP(=O)(O)O)n4cnc5c(N)ncnc45)[C@H]2O	1000000	nM	15341930
CHEMBL3144278	Nc1ncnc2c1ncn2[C@@H]3CO[C@H](COP(=O)(O)O[C@H]4C[C@@H](O[C@@H]4COP(=O)(O)O)n5cnc6c(N)ncnc56)C3	1000000	nM	15341930
CHEMBL293271	C[C@H]1Cn2c(O)nc3ccc(C#N)c(CN1CC=C(C)C)c23	1140000	nM	9857095
CHEMBL292197	C[C@H]1Cn2c(O)nc3cccc(CN1CC=C(C)C)c23	3155000	nM	9857095